Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.66 |
| ▸ | NME2 | P22392 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL11084764 | 1.00 | MEN1 (0.66) | MEN1KMT2ANME2POLBNPC1 | |
| SCHEMBL11088066 | 0.90 | MEN1 (0.59) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL11088062 | 0.90 | MEN1 (0.59) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL11090599 | 0.90 | MEN1 (0.67) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL11090598 | 0.90 | MEN1 (0.67) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL11085210 | 0.87 | MEN1 (0.66) | MEN1KMT2ANME2NPC1RAB9A | |
| SCHEMBL11085206 | 0.87 | MEN1 (0.66) | MEN1KMT2ANME2NPC1RAB9A | |
| SCHEMBL11088153 | 0.86 | CCR3 (0.61) | MEN1KMT2ANME2POLBNPC1 | |
| SCHEMBL11088156 | 0.86 | CCR3 (0.61) | MEN1KMT2ANME2POLBNPC1 | |
| SCHEMBL11080420 | 0.85 | KMT2A (0.86) | MEN1KMT2ANME2POLBRAB9A |
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 |