Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | NFE2L2 | Q16236 | 7/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 5/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TFEB | P19484 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2904918 | 1.00 | HPGD (0.65) | HPGDKDM4ENFE2L2KEAP1NPC1 | |
| SCHEMBL2904853 | 0.82 | MEN1 (0.58) | HPGDKDM4ENPC1MAPTRAB9A | |
| SCHEMBL2904849 | 0.82 | MEN1 (0.58) | HPGDKDM4ENPC1MAPTRAB9A | |
| SCHEMBL2896752 | 0.82 | GPR183 (0.56) | NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2896756 | 0.82 | GPR183 (0.56) | NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL3112646 | 0.79 | HPGD (0.97) | HPGDKDM4ENFE2L2NPC1MAPT | |
| SCHEMBL3112643 | 0.79 | HPGD (0.97) | HPGDKDM4ENFE2L2NPC1MAPT | |
| SCHEMBL2905043 | 0.79 | APP (0.47) | RAB9AALDH1A1 | |
| SCHEMBL2905040 | 0.79 | APP (0.47) | RAB9AALDH1A1 | |
| SCHEMBL2902873 | 0.78 | ALDH1A1 (0.60) | NPC1RAB9AALDH1A1 |
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-2010506-B1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-04 | — | — | EP | disclosed |