Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 6/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7899441 | 1.00 | TAS1R3 (0.47) | TAS1R3TAS1R1LMNAATMALDH1A1 | |
| SCHEMBL7821304 | 0.90 | CYP1A2 (0.48) | LMNAATMALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL7821313 | 0.90 | CYP1A2 (0.48) | LMNAATMALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL5351455 | 0.87 | HTT (0.50) | TAS1R3TAS1R1LMNAALDH1A1KMT2A | |
| SCHEMBL5889370 | 0.87 | HTT (0.50) | TAS1R3TAS1R1LMNAALDH1A1KMT2A | |
| SCHEMBL5355623 | 0.87 | HTT (0.50) | TAS1R3TAS1R1LMNAALDH1A1KMT2A | |
| SCHEMBL7899412 | 0.86 | KMO (0.56) | LMNAALDH1A1HTTKMO | |
| SCHEMBL7907206 | 0.86 | KMO (0.56) | LMNAALDH1A1HTTKMO | |
| SCHEMBL7907182 | 0.86 | KMO (0.56) | LMNAALDH1A1HTTKMO | |
| SCHEMBL7905593 | 0.80 | KMO (0.46) | TAS1R3TAS1R1SMN1; SMN2KMO |
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-6207709-B1 | FOR THERAPY AND PROPHYLAXIS OF NEURODEGENERATIVE DISEASES, SUCH AS HUNTINGTON'S CHOREA, ALZHEIMER'S DISEASE, DEMENTIA CAUSED BY AQUIRED IMMUNODEFICIENCY SYNDROME (AIDS), INFARCTUAL DEMENTIA, CEREBRAL ISCHEMIA, CEREBRAL HYPOXIA, EPILEPSY | PHARMACIA & UPJOHN S.P.A. (IT) | 2001-03-27 | — | — | US | disclosed |