Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 7/20 | 0.42 |
| ▸ | CNR1 | P21554 | 5/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14506761 | 0.73 | GRM5 (0.67) | CD38KDM4ENPC1RAB9AGAA | |
| SCHEMBL14492281 | 0.73 | GRM5 (0.67) | CD38KDM4ENPC1RAB9AGAA | |
| SCHEMBL10162406 | 0.72 | ALDH1A1 (0.64) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL570407 | 0.71 | ALDH1A1 (0.61) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL1901476 | 0.70 | ALDH1A1 (0.60) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL2335762 | 0.70 | ALDH1A1 (0.60) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL10130703 | 0.69 | KDM4E (0.59) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL12200399 | 0.68 | KDM4E (0.55) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL3029855 | 0.68 | NPC1 (0.65) | KDM4EALDH1A1HPGDTSHRNPC1 | |
| SCHEMBL3029857 | 0.68 | NPC1 (0.65) | KDM4EALDH1A1HPGDTSHRNPC1 |
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-2013026163-A1 | HEPATITIS C INHIBITOR COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-02-28 | — | — | WO | disclosed |