Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.34 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29394296 | 0.84 | NPC1 (0.58) | NPC1RAB9ALMNAPOLBTSHR | |
| SCHEMBL285622 | 0.84 | NPC1 (0.58) | NPC1RAB9ALMNAPOLBTSHR | |
| SCHEMBL9408808 | 0.81 | NPC1 (0.43) | NPC1RAB9ALMNAPOLBALDH1A1 | |
| SCHEMBL7752841 | 0.78 | CYP3A4 (0.41) | NPC1RAB9ALMNAPOLBTSHR | |
| SCHEMBL4974302 | 0.76 | NPC1 (0.38) | NPC1RAB9ALMNAPOLBALDH1A1 | |
| SCHEMBL11338684 | 0.75 | NPC1 (0.39) | NPC1RAB9ALMNAPOLBTSHR | |
| SCHEMBL6672691 | 0.75 | NPC1 (0.48) | NPC1RAB9ALMNAPOLBHSD17B10 | |
| Benzotriazole SCHEMBL20580212 | 0.74 | NPC1 (0.46) | NPC1RAB9ALMNAPOLBALDH1A1 | |
| SCHEMBL11408951 | 0.72 | NPC1 (0.43) | NPC1RAB9ALMNAPOLBTSHR | |
| SCHEMBL9408883 | 0.72 | NPC1 (0.40) | NPC1RAB9ALMNAPOLBHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008131921-A1 | SILYLATED, SUBSTITUTED BENZOTRIAZOLYLPHENOL COMPOUNDS | ISDIN S.A. (ES) | 2008-11-06 | — | — | WO | disclosed |
| WO-2008131921-A1 | SILYLATED, SUBSTITUTED BENZOTRIAZOLYLPHENOL COMPOUNDS | ISDIN S.A. (ES) | 2008-11-06 | — | — | WO | disclosed |