Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | NQO2 | P16083 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 5/20 | 0.57 |
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.56 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.56 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 2/20 | 0.54 |
| ▸ | USP7 | Q93009 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | STAT1 | P42224 | 1/20 | 0.53 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11228972 | 0.83 | HSD17B10 (0.57) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6798003 | 0.82 | ALDH1A1 (0.80) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7711731 | 0.82 | SMN1; SMN2 (0.66) | ALDH1A1NPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL4654909 | 0.81 | ALDH1A1 (0.67) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3786463 | 0.80 | NQO2 (0.73) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11216528 | 0.79 | CYP17A1 (0.54) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28742509 | 0.79 | HSD17B10 (0.66) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8577619 | 0.78 | SMN1; SMN2 (0.70) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4189391 | 0.78 | PIP4K2A (0.62) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10663620 | 0.78 | CYP17A1 (0.76) | ALDH1A1NQO2NPC1RAB9ASMN1; SMN2 |
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-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |