Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 4/20 | 0.46 |
| ▸ | HTR2C | P28335 | 4/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | QPCT | Q16769 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 3/20 | 0.42 |
| ▸ | BRAF | P15056 | 3/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18196958 | 0.93 | IDH1 (0.50) | IDH1HTR2AHTR2CEPHX2RAF1 | |
| Hydrochloric Acid SCHEMBL2682150 | 0.92 | RAF1 (0.49) | IDH1HTR2AHTR2CEPHX2RAF1 | |
| SCHEMBL2682353 | 0.82 | EPHX2 (0.64) | HTR2AHTR2CEPHX2RAF1BRAF | |
| SCHEMBL4554237 | 0.81 | BRAF (0.61) | HTR2AHTR2CEPHX2RAF1QPCT | |
| SCHEMBL18196957 | 0.79 | RAF1 (0.48) | IDH1HTR2AHTR2CRAF1MCHR1 | |
| SCHEMBL10220711 | 0.79 | HTR2A (0.56) | HTR2AHTR2CEPHX2QPCTKDR | |
| Hydrochloric Acid SCHEMBL2681808 | 0.78 | HTR2A (0.55) | HTR2AHTR2CEPHX2QPCTKDR | |
| SCHEMBL11008302 | 0.74 | PSEN1 (0.48) | IDH1HTR2AHTR2CEPHX2RAF1 | |
| SCHEMBL18025318 | 0.74 | CA12 (0.47) | IDH1EPHX2KDR | |
| SCHEMBL6874112 | 0.73 | LMNA (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9421211-B2 | N,N′-diarylurea compounds and N,N′-diarylthiourea compounds as inhibitors of translation initiation | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2016-08-23 | — | — | US | disclosed |