Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | GLA | P06280 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.37 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29209445 | 0.81 | TSHR (0.41) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL30463107 | 0.76 | TSHR (0.41) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL30175140 | 0.75 | TSHR (0.40) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL21098141 | 0.75 | ALDH1A1 (0.39) | KDM4EALDH1A1CYP2C19SMN1; SMN2MEN1 | |
| SCHEMBL4773676 | 0.74 | TSHR (0.50) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL31116594 | 0.73 | TSHR (0.49) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL4768985 | 0.72 | CA12 (0.46) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL28395275 | 0.70 | TSHR (0.42) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL30175123 | 0.69 | MAPT (0.37) | TSHRKDM4EALDH1A1GLAGAA | |
| SCHEMBL10314669 | 0.69 | TSHR (0.53) | TSHRKDM4EALDH1A1GLAGAA |
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-111433206-B | Compounds of formula (I) | 葛兰素史克知识产权开发有限公司 | 2023-07-07 | — | — | CN | disclosed |