Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3153900 | 0.98 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2TP53MAPTLMNA | |
| SCHEMBL5537503 | 0.92 | CYP19A1 (0.36) | ALDH1A1SMN1; SMN2TP53MAPTLMNA | |
| SCHEMBL3173918 | 0.80 | NOS1 (0.50) | ALDH1A1LMNACYP3A4SLC18A3CYP1A2 | |
| SCHEMBL8542775 | 0.80 | NOS1 (0.50) | ALDH1A1LMNACYP3A4SLC18A3CYP1A2 | |
| SCHEMBL4766448 | 0.78 | TAAR1 (0.41) | ALDH1A1SMN1; SMN2LMNASLC18A3KMT2A | |
| SCHEMBL6982998 | 0.78 | KDM1A (0.41) | ALDH1A1ATMTSHRNPC1RAB9A | |
| SCHEMBL186274 | 0.78 | NOS1 (0.52) | ALDH1A1LMNACYP3A4SLC18A3CYP1A2 | |
| SCHEMBL6558765 | 0.77 | HTR2C (0.45) | SMN1; SMN2MAPTLMNANPC1RAB9A | |
| SCHEMBL3559920 | 0.76 | CYP2C19 (0.38) | SMN1; SMN2TP53MAPTCYP3A4NPC1 | |
| SCHEMBL2201592 | 0.74 | MAOA (0.42) | NPC1RAB9ACYP19A1GRIA4EPHX1 |
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 |