Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | CTSC | P53634 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7223510 | 0.87 | NPC1 (0.52) | KMT2ANPC1RAB9ACHRNA7ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7231904 | 0.86 | NPC1 (0.51) | KMT2ANPC1RAB9ACHRNA7ALDH1A1 | |
| SCHEMBL7224677 | 0.84 | MEN1 (0.43) | KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL7071352 | 0.84 | ALDH1A1 (0.55) | KMT2ANPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL7225002 | 0.84 | ALDH1A1 (0.55) | KMT2ANPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL7224563 | 0.84 | PTPN1 (0.49) | HDAC6NPC1RAB9ACHRNA7HTR3E | |
| SCHEMBL7226147 | 0.84 | SLC6A3 (0.39) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL7227152 | 0.84 | PKM (0.42) | NPC1RAB9AHPGDALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL7232683 | 0.83 | ALDH1A1 (0.53) | KMT2ANPC1RAB9AHPGDALDH1A1 | |
| Hydrochloric Acid SCHEMBL7073092 | 0.83 | ALDH1A1 (0.53) | KMT2ANPC1RAB9AHPGDALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | claimed |
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | disclosed |