Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL7794055 | 0.77 | SCN5A (0.44) | SMN1; SMN2NPC1RAB9ASCN5ASCN2A | |
| SCHEMBL11768137 | 0.74 | ACHE (0.39) | ALDH1A1SMN1; SMN2NPC1RAB9AACHE | |
| P-Xylene SCHEMBL235090 | 0.72 | ACHE (0.53) | ALDH1A1SMN1; SMN2NPC1RAB9AACHE | |
| SCHEMBL8750708 | 0.72 | TDP1 (0.40) | ALDH1A1SMN1; SMN2NPC1RAB9ASCN5A | |
| SCHEMBL7789999 | 0.70 | HTR3E (0.43) | ALDH1A1SMN1; SMN2NPC1RAB9AACHE | |
| SCHEMBL7793203 | 0.69 | CA1 (0.46) | ALDH1A1SMN1; SMN2KDM4EACHEMAPT | |
| SCHEMBL5987245 | 0.68 | DRD2 (0.59) | ALDH1A1SMN1; SMN2NPC1KDM4EACHE | |
| SCHEMBL171910 | 0.68 | KCNH2 (0.50) | ALDH1A1KDM4ELMNAMAPTCYP2C19 | |
| SCHEMBL5985514 | 0.68 | DRD2 (0.59) | ALDH1A1SMN1; SMN2NPC1KDM4EACHE | |
| SCHEMBL14232115 | 0.67 | DRD2 (0.57) | NPC1KDM4EACHEDRD2DRD4 |
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 |