Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.60 |
| ▸ | NME2 | P22392 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11080895 | 1.00 | RAB9A (0.61) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11081408 | 0.93 | RAB9A (0.60) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11081409 | 0.93 | RAB9A (0.60) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11091289 | 0.91 | RAB9A (0.56) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11091294 | 0.91 | RAB9A (0.56) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11082483 | 0.89 | RAB9A (0.55) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11082481 | 0.89 | RAB9A (0.55) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11085715 | 0.88 | RAB9A (0.56) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11085719 | 0.88 | RAB9A (0.56) | RAB9ANPC1ALOX5NME2CYP1A2 | |
| SCHEMBL11087084 | 0.88 | RAB9A (0.61) | RAB9ANPC1ALOX5NME2CYP1A2 |
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-4428952-A | Substituted pyrrolo[2,1-b]quinazolines and pyrido[2,1-b]quinazolines useful for the treatment of or the prevention of gastrointestinal ulcers | FARMITALIA CARLO ERBA S.P.A. (IT) | 1984-01-31 | — | — | US | disclosed |