Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL1507799 | 0.83 | CYP19A1 (0.46) | CYP19A1ALDH1A1 | |
| SCHEMBL9158480 | 0.78 | CYP19A1 (0.37) | CYP19A1ALDH1A1 | |
| SCHEMBL8767389 | 0.77 | CYP19A1 (0.41) | CYP19A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL9165088 | 0.77 | CA12 (0.47) | CYP19A1 | |
| SCHEMBL9165274 | 0.77 | ALDH1A1 (0.47) | CYP19A1KMT2AALDH1A1 | |
| SCHEMBL9159563 | 0.76 | KIF11 (0.47) | CYP19A1TRPM8 | |
| SCHEMBL1552746 | 0.75 | CYP19A1 (0.38) | CYP19A1 | |
| SCHEMBL9167057 | 0.75 | CYP19A1 (0.47) | CYP19A1KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL9167265 | 0.74 | CYP19A1 (0.37) | AHRCYP19A1KMT2AMAPTPGR | |
| SCHEMBL9163503 | 0.74 | CYP19A1 (0.68) | CYP19A1MAPTALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5473078-A | Aromatase inhibiting compounds | CIBA-GEIGY CORPORATION (US) | 1995-12-05 | — | — | US | disclosed |
| US-5352795-A | Condensing triazolylmethylbenzonitrile with fluorobenzonitrile under basic conditions using alkali metal alkoxide | CIBA-GEIGY CORPORATION (US) | 1994-10-04 | — | — | US | disclosed |
| US-5112845-A | Inhibitors of estrogen synthesis, veterinary medicine | CIBA-GEIGY CORPORATION (US) | 1992-05-12 | — | — | US | disclosed |
| US-4978672-A | Alpha-heterocyclc substituted tolunitriles | CIBA-GEIGY CORPORATION (US) | 1990-12-18 | — | — | US | disclosed |