Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1275398 | 0.97 | TSHR (0.44) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Bromide SCHEMBL17292977 | 0.94 | TSHR (0.42) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7155401 | 0.94 | TSHR (0.42) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Water SCHEMBL28261311 | 0.89 | TSHR (0.38) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8694675 | 0.83 | TSHR (0.38) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Water SCHEMBL5704270 | 0.83 | SLC22A1 (0.41) | TSHRSLC22A1HSD17B10ALDH1A1 | |
| SCHEMBL1275675 | 0.80 | SLC22A1 (0.43) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Water SCHEMBL11564418 | 0.77 | TSHR (0.42) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| Water SCHEMBL11241617 | 0.77 | TSHR (0.42) | TSHRSLC22A1TDP1HSD17B10ALDH1A1 | |
| SCHEMBL7153884 | 0.76 | SLC22A1 (0.50) | TSHRSLC22A1HSD17B10ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117106528-A | Semiconductor substrate cleaning liquid composition | JL化学株式会社 | 2023-11-24 | — | — | CN | claimed |
| CN-111825105-B | Preparation of Y molecular sieve with FAU structure by guide agent method | 中国科学院大连化学物理研究所 | 2022-08-19 | — | — | CN | claimed |
| CN-111825105-A | Preparation of Y molecular sieve with FAU structure by guide agent method | 中国科学院大连化学物理研究所 | 2020-10-27 | — | — | CN | claimed |
| CN-111825100-A | High-silicon Y molecular sieve with FAU topological structure and preparation method thereof | 中国科学院大连化学物理研究所 | 2020-10-27 | — | — | CN | claimed |
| CN-117106528-A | Semiconductor substrate cleaning liquid composition | JL化学株式会社 | 2023-11-24 | — | — | CN | disclosed |
| CN-111825100-B | High-silicon Y molecular sieve with FAU topological structure and preparation method thereof | 中国科学院大连化学物理研究所 | 2023-10-31 | — | — | CN | disclosed |
| CN-111825105-B | Preparation of Y molecular sieve with FAU structure by guide agent method | 中国科学院大连化学物理研究所 | 2022-08-19 | — | — | CN | disclosed |
| CN-111825100-A | High-silicon Y molecular sieve with FAU topological structure and preparation method thereof | 中国科学院大连化学物理研究所 | 2020-10-27 | — | — | CN | disclosed |
| CN-111825105-A | Preparation of Y molecular sieve with FAU structure by guide agent method | 中国科学院大连化学物理研究所 | 2020-10-27 | — | — | CN | disclosed |
| EP-3149432-B1 | A FIBER BRAGG GRATING OPTICAL SENSOR HAVING A NANOPOROUS COATING | TNO (NL) | 2019-02-20 | — | — | EP | disclosed |
| CN-106283097-B | Cleaning liquid composition | 易安爱富科技有限公司 | 2018-12-04 | — | — | CN | disclosed |
| US-9828575-B2 | Cleaner composition | ENF TECHNOLOGY CO., LTD. (KR) | 2017-11-28 | — | — | US | disclosed |
| US-20170138862-A1 | FIBER BRAGG GRATING OPTICAL SENSOR HAVING A NANOPOROUS COATING | NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) | 2017-05-18 | — | — | US | disclosed |
| EP-3149432-A1 | A FIBER BRAGG GRATING OPTICAL SENSOR HAVING A NANOPOROUS COATING | Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) | 2017-04-05 | — | — | EP | disclosed |
| CN-106283097-A | Cleaning liquid composition | 易安爱富科技有限公司 | 2017-01-04 | — | — | CN | disclosed |
| US-20160376532-A1 | CLEANER COMPOSITION | ENF TECHNOLOGY CO., LTD. (KR) | 2016-12-29 | — | — | US | disclosed |
| WO-2015183090-A1 | A FIBER BRAGG GRATING OPTICAL SENSOR HAVING A NANOPOROUS COATING | NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) | 2015-12-03 | — | — | WO | disclosed |
| US-4159964-A | Metal chelate catalyst and alkanolamine hydroxide on adsorptive support | UOP INC. (US) | 1979-07-03 | — | — | US | disclosed |
| US-4127474-A | Treating a petroleum distillate with an alkanolamine hydroxide and a supported oxidation catalyst impregnated with polynuclear aromatic sulfonic acid | UOP INC. (US) | 1978-11-28 | — | — | US | disclosed |
| US-4124494-A | Treating a petroleum distillate with a supported metal phthalocyanine and an alkanolamine hydroxide | UOP INC. (US) | 1978-11-07 | — | — | US | disclosed |