Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.39 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10534693 | 0.89 | CYP19A1 (0.47) | THRATHRBCYP19A1KDM4EALDH1A1 | |
| SCHEMBL10534293 | 0.87 | CYP19A1 (0.47) | THRATHRBCYP19A1SYKCYP24A1 | |
| SCHEMBL8030854 | 0.84 | GPBAR1 (0.55) | ALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9341455 | 0.84 | GPBAR1 (0.54) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL10536475 | 0.83 | CYP19A1 (0.60) | THRATHRBCYP19A1BRD4CREBBP | |
| SCHEMBL10536446 | 0.82 | CYP19A1 (0.48) | THRATHRBCYP19A1PDE4DBRD4 | |
| SCHEMBL10533568 | 0.81 | GPBAR1 (0.53) | THRATHRBALDH1A1SMN1; SMN2 | |
| SCHEMBL10534814 | 0.80 | THRA (0.40) | THRATHRBCYP19A1SMN1; SMN2CYP27A1 | |
| SCHEMBL10534736 | 0.79 | NPC1 (0.47) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL8028175 | 0.79 | CYP19A1 (0.61) | THRATHRBCYP19A1ACHECYP27A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6166031-A | Substituted tetralins, chromans and related compounds in the treatment of asthma | PFIZER INC, (US) | 2000-12-26 | — | — | US | disclosed |
| WO-1989003681-A1 | SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA | PFIZER INC. (US) | 1989-05-05 | — | — | WO | disclosed |
| EP-0313296-A2 | Substituted chromans and related compounds in the treatment of asthma | PFIZER INC. (US) | 1989-04-26 | — | — | EP | disclosed |