Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 4/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939509 | 0.80 | SLC6A2 (0.44) | ALDH1A1HTR2AHTR2CHTR2BSLC6A2 | |
| SCHEMBL7101088 | 0.78 | ACHE (0.64) | HTR2AHTR2CHTR2BACHEHTR1A | |
| SCHEMBL8536280 | 0.77 | KDM4E (0.47) | KDM4EHPGDALDH1A1HSD17B10HTR2B | |
| SCHEMBL14939214 | 0.77 | ACHE (0.62) | KDM4EHPGDALDH1A1HSD17B10SLC6A2 | |
| SCHEMBL6542225 | 0.77 | KDM4E (0.45) | KDM4EHPGDALDH1A1HSD17B10HTR2A | |
| SCHEMBL14939858 | 0.76 | NOS3 (0.50) | SLC6A2SLC6A4SLC6A3CYP19A1LMNA | |
| SCHEMBL5952463 | 0.76 | NOS3 (0.50) | HTR2AHTR2CHTR2BSLC6A3ADRA1A | |
| SCHEMBL10957339 | 0.76 | KDM4E (0.62) | KDM4EHTR2BSLC6A2SLC6A3ACHE | |
| SCHEMBL9374512 | 0.72 | CTH (0.46) | KDM4EHPGDHTR2AHTR2CHTR2B | |
| SCHEMBL15617624 | 0.72 | HTR2A (0.45) | HTR2AHTR2CHTR2BACHEHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |