Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.64 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.57 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 5/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.54 |
| ▸ | ATM | Q13315 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | PPARA | Q07869 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11535652 | 0.87 | CXCR4 (0.60) | ALDH1A1CHRM4CXCR4HPGDATM | |
| SCHEMBL9474213 | 0.85 | CHRM4 (0.53) | ALDH1A1CHRM4CXCR4HPGDATM | |
| SCHEMBL11536219 | 0.85 | CXCR4 (0.64) | CHRM4CXCR4L3MBTL1ATMPOLB | |
| SCHEMBL11536912 | 0.85 | LMNA (0.61) | ALDH1A1CHRM4CXCR4HPGDATM | |
| SCHEMBL11536046 | 0.85 | MMP13 (0.61) | ALDH1A1CHRM4HPGDATMCYP3A4 | |
| SCHEMBL11538782 | 0.85 | LMNA (0.62) | ALDH1A1CHRM4CXCR4ATMPOLB | |
| SCHEMBL20302023 | 0.83 | ALDH1A1 (0.57) | ALDH1A1CHRM4HPGDL3MBTL1ATM | |
| SCHEMBL11539406 | 0.83 | ALDH1A1 (0.63) | ALDH1A1CXCR4L3MBTL1ATMCYP1A2 | |
| SCHEMBL9474220 | 0.82 | CXCR4 (0.51) | ALDH1A1CHRM4CXCR4HPGDATM | |
| SCHEMBL11536229 | 0.81 | CXCR4 (0.53) | ALDH1A1CXCR4L3MBTL1ATMPOLB |
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-4177054-A | PREEMERGENT AND POSTEMERGENT | SCHERING AKTIENGESELLSCHAFT (DE) | 1979-12-04 | — | — | US | claimed |
| US-4177054-A | PREEMERGENT AND POSTEMERGENT | SCHERING AKTIENGESELLSCHAFT (DE) | 1979-12-04 | — | — | US | disclosed |