Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 4/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.40 |
| ▸ | KDR | P35968 | 4/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8748519 | 0.89 | CNR1 (0.49) | ALDH1A1KDM4EMAPTESR2LMNA | |
| SCHEMBL8629617 | 0.83 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTESR2LMNA | |
| SCHEMBL8628489 | 0.83 | EGFR (0.44) | ALDH1A1KDM4EMAPTLMNAPOLB | |
| SCHEMBL8659550 | 0.82 | POLB (0.50) | ALDH1A1MAPTLMNAPOLBALOX5 | |
| SCHEMBL8635317 | 0.80 | PDGFRB (0.42) | ALDH1A1KDM4ELMNAPOLBALOX5 | |
| SCHEMBL4504077 | 0.74 | ALDH1A1 (0.54) | ALDH1A1KDM4EMAPTESR2LMNA | |
| SCHEMBL24400970 | 0.72 | MAPT (0.57) | ALDH1A1KDM4EMAPTESR2HPGD | |
| SCHEMBL6233097 | 0.72 | APLNR (0.53) | ALDH1A1MAPTLMNA | |
| SCHEMBL11776874 | 0.70 | CYP2C19 (0.61) | ALDH1A1MAPTLMNA | |
| SCHEMBL24455917 | 0.70 | CYP2C19 (0.61) | ALDH1A1MAPTLMNA |
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-5709816-A | N,N-DISUBSTITUTED ANILINE COMPOUNDS | KAO CORPORATION (JP) | 1998-01-20 | — | — | US | disclosed |