Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | GAPDH | P04406 | 1/20 | 0.44 |
| ▸ | TOP1 | P11387 | 2/20 | 0.44 |
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.43 |
| ▸ | CFD | P00746 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 3/20 | 0.42 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23614061 | 0.91 | TNFSF11 (0.50) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL11673708 | 0.91 | TSHR (0.57) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL19995438 | 0.86 | PIM1 (0.42) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL27001691 | 0.86 | ACHE (0.54) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL5780141 | 0.86 | MRGPRX4 (0.49) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL3541792 | 0.84 | NCEH1 (0.47) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL9679799 | 0.83 | TSHR (0.55) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL22140253 | 0.82 | TRPV4 (0.41) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL28950231 | 0.80 | PTGS1 (0.40) | TSHRKDM4EALDH1A1GAARAB9A | |
| SCHEMBL27001734 | 0.80 | GSK3B (0.39) | TSHRKDM4EALDH1A1GAARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-108191662-B | Mangosteen alcohol derivative and application thereof | 石家庄学院 | 2020-10-23 | — | — | CN | disclosed |
| WO-2003043976-A1 | METHOD FOR PRODUCING 3,4-DIHYDROXYBENZONITRILE | LONZA AG (CH) | 2003-05-30 | — | — | WO | disclosed |