Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.45 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL892427 | 1.00 | OPRM1 (0.45) | OPRM1OPRD1OPRK1OPRL1CRHR1 | |
| SCHEMBL5469779 | 1.00 | OPRM1 (0.45) | OPRM1OPRD1OPRK1OPRL1CRHR1 | |
| Hydrochloric Acid SCHEMBL28652117 | 0.98 | OPRM1 (0.44) | OPRM1OPRD1OPRK1OPRL1CRHR1 | |
| Hydrochloric Acid SCHEMBL28652116 | 0.98 | OPRM1 (0.44) | OPRM1OPRD1OPRK1OPRL1CRHR1 | |
| SCHEMBL25871714 | 0.85 | HPGD (0.34) | OPRM1OPRD1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL24222041 | 0.84 | OPRL1 (0.43) | OPRM1OPRD1OPRK1OPRL1AKR1C3 | |
| SCHEMBL27549476 | 0.79 | DPP4 (0.33) | — | |
| SCHEMBL14981098 | 0.76 | ANPEP (0.41) | OPRM1OPRD1OPRK1OPRL1AKR1C3 | |
| SCHEMBL5407290 | 0.76 | AKR1C3 (0.41) | OPRM1OPRD1OPRK1OPRL1AKR1C3 | |
| SCHEMBL24262071 | 0.76 | AKR1C3 (0.41) | OPRM1OPRD1OPRK1OPRL1AKR1C3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115087647-A | Synthetic method for preparing 4- (2-chloro-4-methoxy-5-methylphenyl) -N- [ (1S) -2-cyclopropyl-1- (3-fluoro-4-methylphenyl) ethyl ] -5-methyl-N-prop-2-alkynyl-1, 3-thiazol-2-amine | 纽罗克里生物科学有限公司 | 2022-09-20 | — | — | CN | claimed |
| CN-116322668-A | Synthetic method for preparing 4- (2-chloro-4-methoxy-5-methylphenyl) -N- [ (1S) -2-cyclopropyl-1- (3-fluoro-4-methylphenyl) ethyl ] -5-methyl-N-prop-2-ynyl-1, 3-thiazol-2-amine | 纽罗克里生物科学有限公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-115087647-A | Synthetic method for preparing 4- (2-chloro-4-methoxy-5-methylphenyl) -N- [ (1S) -2-cyclopropyl-1- (3-fluoro-4-methylphenyl) ethyl ] -5-methyl-N-prop-2-alkynyl-1, 3-thiazol-2-amine | 纽罗克里生物科学有限公司 | 2022-09-20 | — | — | CN | disclosed |