Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | CASP6 | P55212 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 8/20 | 0.51 |
| ▸ | PDE4A | P27815 | 3/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28034346 | 0.93 | PDE4B (0.53) | TSHRPOLBCASP6PDE4BPDE4A | |
| SCHEMBL28034364 | 0.87 | MAPK1 (0.65) | TSHRPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL29670247 | 0.87 | TSHR (0.66) | TSHRLMNAPDE4BPDE4APDE4C | |
| SCHEMBL15596058 | 0.87 | TSHR (0.66) | TSHRLMNAPDE4BPDE4APDE4C | |
| SCHEMBL30575456 | 0.87 | CA12 (0.63) | TSHRPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL1031663 | 0.87 | CA12 (0.63) | TSHRPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL29882038 | 0.86 | TSHR (0.83) | TSHRPOLBCASP6LMNANPSR1 | |
| SCHEMBL177424 | 0.86 | TSHR (0.83) | TSHRPOLBCASP6LMNANPSR1 | |
| SCHEMBL28033773 | 0.86 | PDE4B (0.55) | TSHRPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL14799306 | 0.83 | TSHR (0.47) | TSHRPOLBCASP6PDE4BPDE4A |
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-105085429-B | Aromatic heterocyclic derivative and application thereof in medicines | 广东东阳光药业有限公司 | 2019-12-10 | — | — | CN | disclosed |
| CN-105085429-A | Heteroaromatic derivative and application thereof to medicament | GUANGDONG HEC PHARMACEUTICAL | 2015-11-25 | — | — | CN | disclosed |