Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 15/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL251196 | 0.74 | — | — | |
| SCHEMBL10424811 | 0.73 | CYP19A1 (0.48) | CYP19A1FOLH1DPP4CYP1A1 | |
| SCHEMBL11361006 | 0.73 | CYP19A1 (0.48) | CYP19A1FOLH1DPP4CYP1A1 | |
| SCHEMBL2384020 | 0.72 | CYP19A1 (0.36) | CYP19A1 | |
| SCHEMBL33258 | 0.70 | — | — | |
| SCHEMBL13088477 | 0.70 | — | — | |
| SCHEMBL11898438 | 0.69 | CYP19A1 (0.44) | CYP19A1FOLH1CYP1A1 | |
| SCHEMBL10374 | 0.69 | CYP19A1 (0.34) | CYP19A1 | |
| SCHEMBL5333181 | 0.69 | — | — | |
| SCHEMBL6483599 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108558871-A | Novel tricyclic compound as anticancer agent | 百时美施贵宝公司 | 2018-09-21 | — | — | CN | disclosed |
| CN-106029663-B | Tricyclic compounds as anticancer agents | 百时美施贵宝公司 | 2018-06-01 | — | — | CN | disclosed |
| CN-107709322-A | Tricyclic compound as anticancer | 百时美施贵宝公司 | 2018-02-16 | — | — | CN | disclosed |