Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10382471 | 0.86 | POLB (0.50) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL11700695 | 0.83 | PTPN1 (0.44) | ALDH1A1HTTMAPTCYP3A4CHRM1 | |
| SCHEMBL28505038 | 0.80 | PTPN1 (0.44) | HTTPOLBCYP3A4ALOX15TDP1 | |
| SCHEMBL282802 | 0.78 | ALDH1A1 (0.58) | ALDH1A1MAPTPOLBCYP3A4CHRM1 | |
| SCHEMBL12964339 | 0.77 | CYP3A4 (0.42) | ALDH1A1POLBCYP3A4CHRM1ALOX15 | |
| SCHEMBL2038792 | 0.77 | ALDH1A1 (0.52) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL70083 | 0.77 | CYP3A4 (0.42) | ALDH1A1POLBCYP3A4CHRM1ALOX15 | |
| SCHEMBL11529244 | 0.77 | CYP3A4 (0.42) | ALDH1A1POLBCYP3A4CHRM1ALOX15 | |
| SCHEMBL5158799 | 0.77 | ALDH1A1 (0.52) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL31553268 | 0.77 | CYP3A4 (0.42) | ALDH1A1POLBCYP3A4CHRM1ALOX15 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023114977-A1 | S1PR4 RECEPTOR ANTAGONISTS AND METHODS OF USE THEREOF | TIAKI THERAPEUTICS, INC. (US) | 2023-06-22 | — | — | WO | disclosed |
| EP-0446173-B1 | Immunoassay for metolachlorine | NOVARTIS AG (CH) | 1999-07-14 | — | — | EP | disclosed |
| US-5576188-A | HYBRIDOMA CELL LINE WHICH PRODUCES A MONOCLONAL ANTIBODY HAVING SPECIFIED CHARACTERISTICS | CIBA-GEIGY CORPORATION (US) | 1996-11-19 | — | — | US | disclosed |
| EP-0446173-A2 | Immunoassay for metolachlorine | CIBA-GEIGY AG (CH) | 1991-09-11 | — | — | EP | disclosed |
| US-4866079-A | INSECTICIDES, MITICIDES | CIBA-GEIGY CORPORATION (US) | 1989-09-12 | — | — | US | disclosed |
| EP-0239535-A2 | N-pyridyloxyphenyl isothiourea, their preparation and use as pesticides | CIBA-GEIGY AG (CH) | 1987-09-30 | — | — | EP | disclosed |
| US-4147804-A | ANTIARRHYTHMIA AGENTS | WILLIAM H. RORER, INC. (US) | 1979-04-03 | — | — | US | disclosed |
| US-4094861-A | Process for the production of non-inflammable polytriazines | BAYER AKTIENGESELLSCHAFT (DT) | 1978-06-13 | — | — | US | disclosed |
| US-4059567-A | High molecular weight polytriazines of soluble polymeric N-cyano-isourea ethers | BAYER AKTIENGESELLSCHAFT (DT) | 1977-11-22 | — | — | US | disclosed |