Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7059599 | 0.84 | ABCB1 (0.42) | ABCB1PPARGATMALDH1A1CYP1A2 | |
| SCHEMBL7063843 | 0.81 | ALDH1A1 (0.46) | ALDH1A1POLBCYP3A4 | |
| SCHEMBL7059611 | 0.81 | KMT2A (0.36) | ABCB1PPARGPOLB | |
| SCHEMBL6677862 | 0.79 | CASP1 (0.43) | — | |
| SCHEMBL6650427 | 0.77 | PPARG (0.47) | ABCB1PPARGATMALDH1A1CYP1A2 | |
| SCHEMBL6958944 | 0.77 | ATM (0.54) | ATMALDH1A1CYP1A2POLBCYP3A4 | |
| SCHEMBL16201457 | 0.77 | ATM (0.54) | ATMALDH1A1CYP1A2POLBCYP3A4 | |
| SCHEMBL7063847 | 0.76 | PPARG (0.50) | PPARG | |
| SCHEMBL6648096 | 0.72 | L3MBTL1 (0.51) | ALDH1A1 | |
| SCHEMBL5700948 | 0.72 | F2 (0.49) | ABCB1ATMALDH1A1CYP1A2POLB |
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-6617332-B1 | Cyclic amidinourea derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 2003-09-09 | — | — | US | disclosed |