Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | RPS6KA2 | Q15349 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9159392 | 0.89 | ALDH1A1 (0.55) | ALDH1A1NPC1RPS6KA2THRBRAB9A | |
| SCHEMBL8828063 | 0.87 | RAB9A (0.49) | ALDH1A1NPC1RAB9ACA12CA9 | |
| SCHEMBL8860030 | 0.87 | CA12 (0.60) | ALDH1A1NPC1RAB9ACA12CA9 | |
| SCHEMBL9134971 | 0.86 | CA12 (0.53) | ALDH1A1NPC1RAB9ACA12CA9 | |
| SCHEMBL9134088 | 0.85 | ALDH1A1 (0.54) | ALDH1A1NPC1RPS6KA2THRBRAB9A | |
| SCHEMBL9159771 | 0.84 | CA12 (0.57) | ALDH1A1NPC1RAB9ACA12CA9 | |
| SCHEMBL9159221 | 0.84 | MEN1 (0.52) | ALDH1A1NPC1RPS6KA2RAB9AKMT2A | |
| SCHEMBL9471237 | 0.84 | NPC1 (0.61) | ALDH1A1NPC1RPS6KA2RAB9ACA12 | |
| SCHEMBL7148208 | 0.81 | NPC1 (0.61) | ALDH1A1NPC1RPS6KA2THRBRAB9A | |
| SCHEMBL9135831 | 0.81 | TDP1 (0.57) | ALDH1A1NPC1RAB9ACA12CA9 |
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-5475106-A | Agonist for cholecystokinin and gastrin receptors; nervous system, gastrointestinal disorders | RHONE-POULENC RORER S.A. (FR) | 1995-12-12 | — | — | US | disclosed |