Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10536475 | 0.88 | CYP19A1 (0.60) | CYP19A1BRD4CREBBPTHRATHRB | |
| SCHEMBL10534293 | 0.85 | CYP19A1 (0.47) | CYP19A1THRATHRBMAOBMAOA | |
| SCHEMBL10534693 | 0.85 | CYP19A1 (0.47) | CYP19A1THRATHRBMAOBMAOA | |
| SCHEMBL8029113 | 0.82 | THRA (0.45) | CYP19A1BRD4CREBBPTHRATHRB | |
| SCHEMBL10534814 | 0.78 | THRA (0.40) | CYP19A1THRATHRBMAOBMAOA | |
| SCHEMBL6827906 | 0.77 | CYP19A1 (0.76) | CYP19A1PDE4D | |
| SCHEMBL8028175 | 0.77 | CYP19A1 (0.61) | CYP19A1THRATHRB | |
| SCHEMBL8030854 | 0.77 | GPBAR1 (0.55) | — | |
| Hydrochloric Acid SCHEMBL9341455 | 0.76 | GPBAR1 (0.54) | — | |
| SCHEMBL10534736 | 0.76 | NPC1 (0.47) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1989003681-A1 | SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA | PFIZER INC. (US) | 1989-05-05 | — | — | WO | disclosed |