Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 5/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL112692 | 0.87 | ALDH1A1 (0.43) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| Benzene SCHEMBL28142453 | 0.85 | MAOA (0.54) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL1027364 | 0.84 | KDM4E (0.51) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| Phthalimide SCHEMBL30722317 | 0.84 | SMN1; SMN2 (0.64) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| Phthalimide SCHEMBL219747 | 0.84 | SMN1; SMN2 (0.64) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL29779636 | 0.83 | MAOA (0.56) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL51539 | 0.83 | MAOA (0.56) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL9462895 | 0.82 | MAOA (0.54) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| Ammonia Solution, Strong SCHEMBL27791525 | 0.82 | MAOA (0.54) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A | |
| SCHEMBL28307982 | 0.82 | MAOA (0.54) | TSHRSMN1; SMN2KDM4EALDH1A1KMT2A |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106094440-B | Lower layer film for lithography forming material, lower layer film for lithography and pattern forming method | 三菱瓦斯化学株式会社 | 2019-11-22 | — | — | CN | disclosed |
| EP-3191184-A1 | STRUCTURE MODIFYING APPARATUS | The Procter and Gamble Company (US) | 2017-07-19 | — | — | EP | disclosed |
| EP-3191183-A1 | STRUCTURE MODIFYING APPARATUS | The Procter and Gamble Company (US) | 2017-07-19 | — | — | EP | disclosed |
| CN-106795384-A | Carbon coated metallic particles, article and the purposes being dispersed through | 柯达公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-106462072-A | Lithographic film formation material, composition for lithographic film formation, lithographic film, pattern formation method, and purification method | 三菱瓦斯化学株式会社 | 2017-02-22 | — | — | CN | disclosed |
| WO-2016040215-A1 | STRUCTURE MODIFYING APPARATUS | THE PROCTER & GAMBLE COMPANY (US) | 2016-03-17 | — | — | WO | disclosed |
| WO-2016040216-A1 | STRUCTURE MODIFYING APPARATUS | THE PROCTER & GAMBLE COMPANY (US) | 2016-03-17 | — | — | WO | disclosed |
| EP-2424947-A1 | COMPOSITIONS AND METHODS INCORPORATING PHOTOCATALYSTS | The Procter & Gamble Company (US) | 2012-03-07 | — | — | EP | disclosed |
| EP-2384457-A2 | COATING COMPOSITIONS | AZ Electronic Materials USA Corp. (US) | 2011-11-09 | — | — | EP | disclosed |
| WO-2010126919-A1 | COMPOSITIONS AND METHODS INCORPORATING PHOTOCATALYSTS | THE PROCTER & GAMBLE COMPANY (US) | 2010-11-04 | — | — | WO | disclosed |
| WO-2010055406-A2 | COATING COMPOSITIONS | AZ ELECTRONIC MATERIALS USA CORP. (US) | 2010-05-20 | — | — | WO | disclosed |