Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8955867 | 0.87 | ALDH1A1 (0.51) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL11015773 | 0.82 | CYP19A1 (0.51) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL11752589 | 0.81 | CYP19A1 (0.50) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL11736925 | 0.81 | IDO1 (0.45) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL11734890 | 0.77 | KMT2A (0.47) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL8955983 | 0.76 | CYP19A1 (0.38) | CYP19A1MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL270612 | 0.75 | CYP11B1 (0.67) | CYP19A1MEN1POLBKMT2ACYP1A2 | |
| SCHEMBL11736720 | 0.74 | IDO1 (0.48) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL11069974 | 0.74 | IDO1 (0.50) | CYP19A1IDO1MEN1POLBKMT2A | |
| SCHEMBL10926345 | 0.74 | IDO1 (0.47) | CYP19A1IDO1MEN1POLBKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5486533-A | DIAZOLE OR TRIAZOLES WITH SILFIDES | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1994008978-A1 | FUNGICIDAL SUBSTITUTED AZOLE DERIVATIVES | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1994-04-28 | — | — | WO | disclosed |