Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | ESRRG | P62508 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.47 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10893771 | 0.91 | ESRRG (0.57) | BACE1BCHEALDH1A1MAPTNPSR1 | |
| SCHEMBL11403004 | 0.90 | KCNK3 (0.55) | BCHEALDH1A1MAPTHTTESRRG | |
| SCHEMBL11520432 | 0.85 | KCNK3 (0.53) | BACE1ALDH1A1MAPTNPSR1HTT | |
| SCHEMBL11501881 | 0.82 | KMT2A (0.54) | BCHEALDH1A1MAPTNPSR1HTT | |
| SCHEMBL11867225 | 0.82 | KCNK3 (0.61) | KCNK3NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL9357969 | 0.82 | RAB9A (0.51) | ALDH1A1MAPTCYP1A2NPC1RAB9A | |
| SCHEMBL11797044 | 0.81 | RAB9A (0.51) | BACE1BCHEALDH1A1MAPTNPSR1 | |
| SCHEMBL11803186 | 0.81 | ALDH1A1 (0.49) | ALDH1A1MAPTCYP3A4NPC1RAB9A | |
| SCHEMBL11523483 | 0.81 | POLB (0.54) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8356134 | 0.80 | KCNK3 (0.63) | BCHEALDH1A1MAPTHTTESRRG |
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-4139528-A | Water-insoluble monoazo dyestuffs which is a diazotized 6-cyano-2:4-dinitroaniline coupled to a m-acylamino-substituted aniline | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1979-02-13 | — | — | US | disclosed |