Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL11210777 | 0.87 | KMT2A (0.43) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| Pyridine SCHEMBL11569632 | 0.84 | KDM4E (0.36) | KDM4ETDP1CYP3A4 | |
| Pyridine SCHEMBL11205049 | 0.83 | CYP17A1 (0.38) | CYP17A1NPC1RAB9AKDM4EALDH1A1 | |
| Pyridine SCHEMBL11210901 | 0.82 | LMNA (0.32) | NPC1RAB9AALDH1A1SMN1; SMN2LMNA | |
| Pyridine SCHEMBL11207622 | 0.82 | SMN1; SMN2 (0.35) | NPC1KDM4EALDH1A1SMN1; SMN2HTT | |
| SCHEMBL11569712 | 0.80 | CA1 (0.50) | NPC1RAB9AKDM4EALDH1A1NPSR1 | |
| SCHEMBL11213027 | 0.79 | CA1 (0.52) | NPC1RAB9AKDM4EALDH1A1NPSR1 | |
| SCHEMBL11203843 | 0.73 | CA1 (0.46) | KDM4EALDH1A1SMN1; SMN2LMNANPSR1 | |
| Pyridine SCHEMBL11208261 | 0.73 | CYP3A4 (0.33) | KDM4ESMN1; SMN2LMNAL3MBTL1CYP3A4 | |
| Perchlorate SCHEMBL11502902 | 0.73 | NQO1 (0.52) | NPC1KDM4EALDH1A1SMN1; SMN2MITF |
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-0003897-A1 | Phosphinegold(I)salts, process for their preparation and compositions containing them | SMITHKLINE BECKMAN CORPORATION (US) | 1979-09-05 | — | — | EP | disclosed |