Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 7/20 | 0.35 |
| ▸ | HTR2A | P28223 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7031087 | 0.88 | HTR2C (0.35) | HTR2CHTR2ATSHRUSP2ALDH1A1 | |
| SCHEMBL7038309 | 0.82 | HTR6 (0.38) | HTR2CHTR2ATSHRUSP2ALDH1A1 | |
| SCHEMBL7033472 | 0.81 | RORC (0.31) | HTR2CHTR2ATSHRUSP2ALDH1A1 | |
| Oxalic Acid SCHEMBL6492860 | 0.71 | HTR2C (0.52) | HTR2CHTR2AHSD17B10TP53ALOX15 | |
| SCHEMBL6498458 | 0.69 | HTR2C (0.40) | HTR2CHTR2AHSD17B10ALOX15MAPK1 | |
| Maleic Acid SCHEMBL6495798 | 0.69 | HTR2C (0.35) | HTR2CHTR2ASIGMAR1HTR6 | |
| Fumaric Acid SCHEMBL6495804 | 0.69 | HTR2C (0.35) | HTR2CHTR2ASIGMAR1HTR6 | |
| SCHEMBL6507779 | 0.69 | HTR2C (0.58) | HTR2CHTR2AHSD17B10TP53ALOX15 | |
| Oxalic Acid SCHEMBL6496558 | 0.68 | HTR2C (0.44) | HTR2CHTR2AALDH1A1KDM4EHTR6 | |
| SCHEMBL6507807 | 0.66 | HTR2C (0.48) | HTR2CHTR2AHSD17B10ALOX15MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1173440-B1 | TETRACYCLIC AZEPINOINDOLE COMPOUNDS AS 5-HT RECEPTOR LIGANDS | UPJOHN CO (US) | 2004-09-15 | — | — | EP | claimed |