Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | NLN | Q9BYT8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4764109 | 0.72 | ENPP1 (0.39) | BCHEMAPTALOX15PPARGPPARA | |
| SCHEMBL4722240 | 0.70 | HTR1B (0.37) | BCHEMAPTSMN1; SMN2ALOX15KDM4E | |
| SCHEMBL5097262 | 0.69 | TLR8 (0.39) | BCHEPPARGPPARACNR2ALDH1A1 | |
| SCHEMBL8560624 | 0.65 | BCHE (0.51) | BCHEMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL6489268 | 0.64 | BCHE (0.40) | BCHEMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL4539527 | 0.64 | NOS1 (0.41) | BCHEMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL22229843 | 0.63 | CYP11B1 (0.54) | MAPTSMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL331127 | 0.63 | GABRA1 (0.54) | — | |
| Ammonia Solution, Strong SCHEMBL3156160 | 0.62 | ALDH1A1 (0.56) | MAPTSMN1; SMN2KDM4ENISCHALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL30504373 | 0.62 | ALDH1A1 (0.56) | MAPTSMN1; SMN2KDM4ENISCHALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0821675-A1 | NOVEL HYDROXAMIC ACID AND AMINO-CARBOXYLATE COMPOUNDS AS METALLOPROTEASE AND TNF INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996033176-A1 | NOVEL HYDROXAMIC ACID AND AMINO-CARBOXYLATE COMPOUNDS AS METALLOPROTEASE AND TNF INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-10-24 | — | — | WO | disclosed |