Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CES2 | O00748 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9299353 | 0.87 | HPGD (0.60) | CYP2C9CYP2C19HPGDKDM4EALDH1A1 | |
| SCHEMBL28968096 | 0.84 | ALDH1A1 (0.56) | CYP2C9CYP2C19HPGDKDM4EALDH1A1 | |
| SCHEMBL18455052 | 0.82 | CYP2C9 (0.54) | CYP2C9CYP2C19HPGDKDM4EALDH1A1 | |
| SCHEMBL28342942 | 0.79 | HPGD (0.52) | CYP2C9CYP2C19HPGDKDM4EALDH1A1 | |
| SCHEMBL1556598 | 0.78 | MEN1 (0.59) | CYP2C9CYP2C19KMT2AGAAMAPT | |
| SCHEMBL28637086 | 0.76 | CES2 (0.54) | CYP2C9CYP2C19HPGDKDM4EALDH1A1 | |
| SCHEMBL11802784 | 0.76 | CES2 (0.67) | HPGDKDM4EALDH1A1CES2KMT2A | |
| SCHEMBL11047986 | 0.75 | CYP2C9 (0.48) | CYP2C9CYP2C19HPGDKDM4EALDH1A1 | |
| SCHEMBL8633064 | 0.74 | SLC6A2 (0.59) | KDM4EKMT2AMEN1 | |
| SCHEMBL31406174 | 0.74 | CES2 (0.69) | HPGDALDH1A1CES2KMT2AMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4257952-A | PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES | STERLING DRUG INC. (US) | 1981-03-24 | — | — | US | disclosed |
| US-4172834-A | ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS | STERLING DRUG INC. (US) | 1979-10-30 | — | — | US | disclosed |
| US-4062864-A | ANALGESIC, PSYCHOTROPIC, ANTIHISTAMINE | STERLING DRUG INC. (US) | 1977-12-13 | — | — | US | disclosed |
| US-3959309-A | ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE | STERLING DRUG INC. (US) | 1976-05-25 | — | — | US | disclosed |