Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 8/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.46 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALPG | P10696 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3475924 | 0.85 | ALDH1A1 (0.46) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL20298611 | 0.85 | ALDH1A1 (0.46) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL9777568 | 0.82 | CHAT (1.00) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL3318878 | 0.82 | CHAT (1.00) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL8991523 | 0.81 | MEN1 (0.69) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL9140957 | 0.81 | MEN1 (0.69) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL2780056 | 0.81 | HDAC8 (0.41) | CHATRAB9AALDH1A1MAPTKDM4E | |
| Bromide SCHEMBL29216857 | 0.80 | CHAT (0.95) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL372527 | 0.80 | CHAT (0.61) | CHATRAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL658342 | 0.79 | HDAC8 (0.64) | CHATRAB9AALDH1A1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| JP-59002009-A | — | — | None | — | — | JP | disclosed |
| JP-S592009-A | MANUFACTURE OF COLOR FILTER | TOSHIBA CORP | 1984-01-07 | — | — | JP | disclosed |