Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.79 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.79 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.79 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.79 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.79 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.79 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HTR1D | P28221 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 5/20 | 0.53 |
| ▸ | DRD4 | P21917 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29389745 | 0.89 | HTR1A (1.00) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL2230435 | 0.89 | HTR1A (1.00) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8445766 | 0.89 | HTR1A (0.77) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL4087689 | 0.89 | HTR1A (1.00) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8442303 | 0.87 | HTR1A (0.74) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8443054 | 0.87 | HTR1A (0.74) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8443296 | 0.87 | HTR1A (0.74) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8442534 | 0.86 | HTR1A (0.80) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8445447 | 0.85 | ALDH1A1 (0.71) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL8444648 | 0.85 | HTR1A (0.71) | HTR1AALDH1A1KDM4ECYP1A2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0395312-B1 | Piperazine derivatives | WYETH JOHN & BROTHER LTD (GB) | 1999-05-12 | — | — | EP | claimed |
| US-5382583-A | Hydroxytryptamine antagonists | JOHN WYETH & BROTHER, LIMITED (GB) | 1995-01-17 | — | — | US | claimed |
| EP-0395312-A2 | Piperazine derivatives | JOHN WYETH & BROTHER LIMITED (GB) | 1990-10-31 | — | — | EP | claimed |