Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.35 |
| ▸ | HTR3B | O95264 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2478208 | 0.98 | CYP1A2 (0.38) | NPC1RAB9AALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL7794523 | 0.93 | HTR3E (0.37) | NPC1RAB9AALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL7784569 | 0.89 | ACHE (0.40) | NPC1RAB9AALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL7793278 | 0.81 | HTR3E (0.34) | NPC1RAB9AALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL7793328 | 0.79 | HTR3E (0.38) | NPC1RAB9ASMN1; SMN2CYP2D6CYP2C9 | |
| SCHEMBL723225 | 0.77 | ALDH1A1 (0.39) | ALDH1A1HPGDTSHRKMT2AMAPT | |
| SCHEMBL7418307 | 0.76 | SLC22A2 (0.37) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL7794037 | 0.75 | CA12 (0.44) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL1007488 | 0.75 | EPHX1 (0.48) | NPC1RAB9AALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL3146112 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TSHRMEN1KMT2ASLC18A3 |
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-1150963-A1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | Aventis Pharma Deutschland GmbH (DE) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000046214-A1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2000-08-10 | — | — | WO | disclosed |