Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.46 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9319873 | 0.95 | CYP3A4 (0.45) | CYP3A4CYP2C9ERCC1ERCC4SIGMAR1 | |
| SCHEMBL9319368 | 0.92 | MEN1 (0.47) | CYP3A4CYP2C9ERCC1ERCC4SIGMAR1 | |
| SCHEMBL9319338 | 0.89 | CCR5 (0.45) | CYP3A4CYP2C9ERCC1ERCC4SIGMAR1 | |
| SCHEMBL9320919 | 0.85 | OPRM1 (0.50) | CYP3A4CYP2C9ERCC1ERCC4CCR5 | |
| SCHEMBL9319058 | 0.84 | CCR5 (0.45) | CYP3A4CYP2C9ERCC1ERCC4SIGMAR1 | |
| SCHEMBL9321052 | 0.82 | UTS2R (0.42) | CYP3A4CYP2C9SIGMAR1LMNAALDH1A1 | |
| SCHEMBL9321088 | 0.82 | ERCC1 (0.49) | CYP3A4CYP2C9ERCC1ERCC4SIGMAR1 | |
| SCHEMBL9320920 | 0.81 | OPRM1 (0.47) | — | |
| SCHEMBL9321131 | 0.81 | CA12 (0.40) | SMN1; SMN2L3MBTL1CA12CA1CA2 | |
| SCHEMBL9319856 | 0.78 | CYP3A4 (0.47) | CYP3A4CYP2C9ERCC1ERCC4SIGMAR1 |
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-5350861-A | Insecticides, acaricides, fungicides, antimycotic agents | BAYER AKTIENGESELLSCHAFT (DE) | 1994-09-27 | — | — | US | disclosed |