Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 3/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11847447 | 0.96 | TSHR (0.46) | KDM4EUSP2MAPTTSHRATM | |
| SCHEMBL11845163 | 0.79 | KDM4E (0.41) | KDM4EUSP2MAPTTSHRATM | |
| SCHEMBL27851767 | 0.72 | TSHR (0.59) | KDM4EUSP2MAPTTSHRATM | |
| SCHEMBL11841207 | 0.72 | HTR2C (0.44) | KDM4EUSP2MAPTTSHR | |
| Hydrochloric Acid SCHEMBL27833742 | 0.71 | TSHR (0.57) | KDM4EUSP2MAPTTSHRATM | |
| SCHEMBL11861840 | 0.71 | TSHR (0.61) | KDM4EUSP2MAPTTSHRATM | |
| SCHEMBL11845578 | 0.70 | NPSR1 (0.40) | KDM4EUSP2MAPTTSHRALDH1A1 | |
| SCHEMBL11847454 | 0.68 | HTR2C (0.45) | KDM4EUSP2MAPTTSHR | |
| SCHEMBL11845059 | 0.68 | PGR (0.38) | KDM4EUSP2MAPTTSHRPGR | |
| SCHEMBL11843939 | 0.66 | KDM4E (0.38) | KDM4EUSP2MAPTTSHRPGR |
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 |
|---|---|---|---|---|---|---|---|
| US-3980788-A | XANTHENYL COMPOUNDS | SMITHKLINE CORPORATION (US) | 1976-09-14 | — | — | US | claimed |
| US-3980788-A | XANTHENYL COMPOUNDS | SMITHKLINE CORPORATION (US) | 1976-09-14 | — | — | US | disclosed |