Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9436366 | 0.81 | CYP1A2 (0.48) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL28739411 | 0.78 | KMT2A (0.44) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL701485 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL3275634 | 0.74 | CYP2C19 (0.47) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL11021443 | 0.73 | CYP1A2 (0.43) | ALDH1A1CYP2C19HIF1ALMNACYP1A2 | |
| SCHEMBL6283925 | 0.72 | PIN1 (0.50) | ALDH1A1MAPTTSHROPRM1KMT2A | |
| SCHEMBL584028 | 0.71 | CYP2C19 (0.47) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL7899580 | 0.71 | CYP2C19 (0.47) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL5570579 | 0.71 | CYP2C19 (0.47) | ALDH1A1MAPTTSHRCYP2C19HIF1A | |
| SCHEMBL6283931 | 0.71 | GABRA1 (0.36) | ALDH1A1MAPTTSHRCYP2C19HIF1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5164386-A | Gastrointestinal and respiratory disorders | ISTITUTO DE ANGELI S.P.A. (IT) | 1992-11-17 | — | — | US | disclosed |
| EP-0404737-A2 | New R(-) 3-quinuclidinol derivatives | BOEHRINGER INGELHEIM ITALIA S.p.A. (IT) | 1990-12-27 | — | — | EP | disclosed |