Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.31 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8197027 | 0.77 | TP53 (0.39) | ADRA2CNPC1RAB9APAX8JAK2 | |
| SCHEMBL7774837 | 0.76 | TP53 (0.44) | ADRA2CNPC1RAB9APAX8JAK2 | |
| SCHEMBL9535269 | 0.74 | MEN1 (0.35) | ADRA2CMEN1KMT2A | |
| SCHEMBL4376051 | 0.74 | POLB (0.33) | RAB9ASMN1; SMN2CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL7974364 | 0.73 | HDAC1 (0.49) | NPC1RAB9ASMN1; SMN2CYP2C19MEN1 | |
| SCHEMBL4379243 | 0.73 | PTGDR2 (0.36) | RAB9ACYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL7977296 | 0.73 | PTGDR2 (0.43) | RAB9ACYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL7988993 | 0.73 | KDM4E (0.34) | SMN1; SMN2CYP2C19MEN1CYP3A4CYP2C9 | |
| SCHEMBL7991138 | 0.72 | TSPO (0.39) | CYP2C19CYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL8105543 | 0.72 | LMNA (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6248765-B1 | ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) | 2001-06-19 | — | — | US | claimed |