Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | MAOA | P21397 | 3/20 | 0.60 |
| ▸ | MAOB | P27338 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | IL1B | P01584 | 1/20 | 0.51 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.48 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28334006 | 0.88 | ALDH1A1 (0.67) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL11643032 | 0.86 | MAOA (0.67) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL14646374 | 0.82 | SMN1; SMN2 (0.48) | NPC1RAB9AALDH1A1HTTTDP1 | |
| SCHEMBL17491520 | 0.81 | HDAC1 (0.49) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL3122347 | 0.81 | MAOA (0.55) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL27312591 | 0.80 | TACR1 (0.52) | NPC1RAB9AALDH1A1HTTTDP1 | |
| SCHEMBL2475258 | 0.77 | NPC1 (0.60) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL31538897 | 0.77 | TACR1 (0.43) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL31538906 | 0.76 | NPC1 (0.43) | NPC1RAB9AMAOAMAOBALDH1A1 | |
| SCHEMBL14646359 | 0.76 | CXCR4 (0.45) | MAPTGAA |
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-1453901-A1 | CATALYTIC PGM MIXTURE FOR HYDROSILYLATION | RHODIA CHIMIE (FR) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003050174-A1 | CATALYTIC PGM MIXTURE FOR HYDROSILYLATION | RHODIA CHIMIE (FR) | 2003-06-19 | — | — | WO | disclosed |