Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6194180 | 0.83 | TTK (0.43) | — | |
| SCHEMBL27811477 | 0.81 | ALDH1A1 (0.53) | CYP19A1 | |
| SCHEMBL15474587 | 0.81 | ALOX5 (0.50) | CYP1A2CYP2C19 | |
| SCHEMBL4218764 | 0.77 | CYP1A2 (0.35) | CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL7033071 | 0.77 | CA4 (0.43) | CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL7703136 | 0.77 | LTA4H (0.46) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1459163 | 0.76 | TSHR (0.48) | CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL17047385 | 0.76 | KDM4E (0.50) | — | |
| SCHEMBL8125229 | 0.76 | METAP2 (0.38) | — | |
| SCHEMBL8461967 | 0.76 | GSTP1 (0.54) | CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6048863-A | SEXUAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-04-11 | — | — | US | disclosed |