Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | ACACB | O00763 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8170006 | 0.88 | ALDH1A1 (0.46) | ALDH1A1KMT2ALMNACYP1A2TSHR | |
| SCHEMBL3300820 | 0.86 | PDE3B (0.42) | ALDH1A1ACACBMAPT | |
| SCHEMBL11375563 | 0.85 | ALDH1A1 (0.44) | ALDH1A1LMNANPC1HPGDTSHR | |
| SCHEMBL1059319 | 0.85 | ALDH1A1 (0.44) | ALDH1A1NPC1HPGDMAPK1RAB9A | |
| SCHEMBL1974876 | 0.82 | P4HTM (0.58) | ALDH1A1ACACBLMNACYP1A2NPC1 | |
| SCHEMBL103271 | 0.81 | ACACB (0.45) | ALDH1A1ACACBKMT2APARP10POLB | |
| SCHEMBL9566849 | 0.80 | P4HTM (0.63) | ALDH1A1KMT2ALMNAMEN1CYP1A2 | |
| SCHEMBL9566772 | 0.80 | ALDH1A1 (0.38) | ALDH1A1ACACBKMT2AMEN1HPGD | |
| SCHEMBL509590 | 0.80 | ALDH1A1 (0.47) | ALDH1A1ACACBNPC1HPGDRAB9A | |
| SCHEMBL7410889 | 0.80 | ESR1 (0.45) | ALDH1A1LMNACYP1A2NPC1RAB9A |
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-5444056-A | Hypotensive agnets, calcium channel blockers | SANOFI (FR) | 1995-08-22 | — | — | US | disclosed |