Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9736562 | 0.74 | MDM2 (0.44) | ALDH1A1CYP2C19CYP2C9RECQLRAB9A | |
| SCHEMBL11447465 | 0.73 | MEN1 (0.51) | ALDH1A1CYP2C19CYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL8001508 | 0.72 | SLC7A5 (0.50) | ALDH1A1CYP2C19CYP1A2CYP2C9RECQL | |
| SCHEMBL8001504 | 0.72 | SLC7A5 (0.50) | ALDH1A1CYP2C19CYP1A2CYP2C9RECQL | |
| SCHEMBL26065 | 0.72 | MDM2 (0.68) | ALDH1A1CYP1A2MDM2KMT2ACES2 | |
| SCHEMBL1822406 | 0.70 | PGR (0.53) | ALDH1A1RAB9ASMN1; SMN2MDM2MEN1 | |
| SCHEMBL289556 | 0.70 | PGR (0.53) | ALDH1A1RAB9ASMN1; SMN2MDM2MEN1 | |
| SCHEMBL9735929 | 0.69 | OPRM1 (0.44) | MDM2LMNAL3MBTL1 | |
| SCHEMBL867896 | 0.69 | ALDH1A1 (0.53) | ALDH1A1CYP2C19CYP1A2CYP2C9RECQL | |
| SCHEMBL2985359 | 0.68 | CES1 (0.54) | ALDH1A1CYP2C19RECQLRAB9ASMN1; 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-5118685-A | Antiarrhythmia agents | BASF AKTIENGESELLSCHAFT (DE) | 1992-06-02 | — | — | US | disclosed |