Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL28247428 | 0.79 | CYP3A4 (0.43) | CYP3A4TDP1ESR1ESR2 | |
| SCHEMBL17124467 | 0.77 | CYP3A4 (0.31) | CYP3A4TDP1 | |
| SCHEMBL25524248 | 0.77 | CYP3A4 (0.41) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL29962009 | 0.76 | CYP3A4 (0.39) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL30085602 | 0.74 | TDP1 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL10792614 | 0.74 | TDP1 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL15698213 | 0.74 | CYP3A4 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL31347392 | 0.74 | TDP1 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL10718341 | 0.74 | TDP1 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| Bromide SCHEMBL31398207 | 0.74 | CYP3A4 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 |
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-5530162-A | Process for the hydrogenation of aryl phosphines and products obtained therefrom | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1996-06-25 | — | — | US | claimed |
| WO-1993021192-A1 | PROCESS FOR THE HYDROGENATION OF ARYL PHOSPHINES AND PRODUCTS OBTTAINED THEREFROM | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1993-10-28 | — | — | WO | claimed |