Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29484201 | 0.83 | NPSR1 (0.41) | OPRD1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29484199 | 0.79 | MEN1 (0.45) | OPRD1MAPTKMT2AALDH1A1KDM4E | |
| SCHEMBL29484200 | 0.79 | MEN1 (0.45) | OPRD1MAPTKMT2AALDH1A1KDM4E | |
| SCHEMBL30586630 | 0.75 | GAA (0.58) | OPRD1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5922588 | 0.75 | GSK3B (0.48) | MAPTKMT2AALDH1A1KDM4ENPSR1 | |
| SCHEMBL29484198 | 0.73 | MEN1 (0.45) | OPRD1MAPTKMT2AALDH1A1KDM4E | |
| SCHEMBL29484194 | 0.73 | OPRM1 (0.48) | OPRD1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28667377 | 0.72 | ALDH1A1 (0.67) | MAPTCYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL5226813 | 0.72 | GSK3B (0.56) | MAPTKMT2AALDH1A1KDM4ENPSR1 | |
| SCHEMBL29484195 | 0.72 | ALDH1A1 (0.54) | OPRD1MAPTCYP3A4CYP2C9CYP2C19 |
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-111875591-B | Method for catalytic synthesis of drug intermediate 3-benzo [ d ] imidazole benzopyrone derivative | 马鞍山市泰博化工科技有限公司 | 2022-03-15 | — | — | CN | disclosed |