Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.37 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | LHCGR | P22888 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18696087 | 0.98 | CYP1B1 (0.46) | CYP1B1NPC1RAB9AADCY8ADCY1 | |
| SCHEMBL6827164 | 0.93 | NPC1 (0.41) | CYP1B1NPC1RAB9AMAPTPGR | |
| SCHEMBL6824261 | 0.87 | PRKDC (0.41) | CYP1B1NPC1RAB9APGRCYP1A2 | |
| SCHEMBL6923317 | 0.83 | L3MBTL1 (0.42) | CYP1B1ADCY8ADCY1KDM4EALDH1A1 | |
| SCHEMBL6827392 | 0.82 | MAOA (0.39) | CYP1B1NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL6829543 | 0.79 | PGR (0.43) | CYP1B1NPC1RAB9AKMT2APGR | |
| SCHEMBL6823828 | 0.79 | PGR (0.46) | PGRPRKDC | |
| SCHEMBL6824341 | 0.78 | ALDH1A1 (0.45) | CYP1B1NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6827379 | 0.77 | CYP1B1 (0.54) | CYP1B1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL6827470 | 0.75 | NQO2 (0.47) | NPC1RAB9AALDH1A1HPGDKMT2A |
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-2004050624-A1 | SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES | C & C RESEARCH LABORATORIES (KR) | 2004-06-17 | — | — | WO | disclosed |