Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.39 |
| ▸ | F7 | P08709 | 1/20 | 0.39 |
| ▸ | F3 | P13726 | 1/20 | 0.39 |
| ▸ | MAP2 | P11137 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | ICMT | O60725 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | CHUK | O15111 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31070513 | 0.95 | KIF11 (0.41) | KIF11OPRM1OPRK1OPRL1F7 | |
| SCHEMBL31083748 | 0.90 | KIF11 (0.48) | KIF11OPRM1OPRK1OPRL1HSD17B3 | |
| SCHEMBL31070603 | 0.89 | HSD17B3 (0.47) | KIF11HSD17B3MAP2IDO1NR4A2 | |
| SCHEMBL31070623 | 0.89 | ECE1 (0.40) | KIF11CDK4CCND1NR4A2 | |
| SCHEMBL31070531 | 0.89 | MAP2 (0.44) | KIF11HSD17B3MAP2IDO1NR4A2 | |
| SCHEMBL31070567 | 0.88 | KIF11 (0.44) | KIF11IDO1CDK4CCND1NR4A2 | |
| SCHEMBL31070662 | 0.88 | IDO1 (0.38) | IDO1NR4A2ICMTMAPTHTR6 | |
| SCHEMBL31070544 | 0.88 | ICMT (0.43) | OPRM1OPRK1OPRL1MAP2IDO1 | |
| SCHEMBL31070555 | 0.88 | KIF11 (0.47) | KIF11OPRM1OPRK1OPRL1F7 | |
| SCHEMBL31070497 | 0.87 | NR4A2 (0.42) | NR4A2ICMTMAPTHTR6IKBKB |
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 |
|---|---|---|---|---|---|---|---|
| CN-118515600-A | Isoindoline compound and medical application thereof | 中国科学院上海药物研究所 | 2024-08-20 | — | — | CN | disclosed |