Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8898069 | 0.92 | NCEH1 (0.33) | NCEH1 | |
| SCHEMBL8895630 | 0.89 | NCEH1 (0.34) | NCEH1CYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL8896380 | 0.79 | NCEH1 (0.33) | NCEH1KDM4EALDH1A1LMNAKMT2A | |
| SCHEMBL8898418 | 0.79 | KDM4E (0.37) | NCEH1CYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL8898141 | 0.78 | MEN1 (0.33) | KDM4EMAPTTDP1ALDH1A1GAA | |
| SCHEMBL8897205 | 0.75 | KDM4E (0.32) | CYP1A2CYP2C19HSD17B10KDM4EALDH1A1 | |
| SCHEMBL8898063 | 0.71 | MEN1 (0.32) | KDM4EMAPTTDP1ALDH1A1LMNA | |
| SCHEMBL5457448 | 0.71 | NCEH1 (0.43) | NCEH1CYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL8899743 | 0.70 | PARP1 (0.34) | KDM4EALDH1A1GAAKMT2A | |
| SCHEMBL5852964 | 0.70 | LMNA (0.39) | CYP1A2ALDH1A1LMNA |
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-5703091-A | N-substituted azabicycloalkane derivatives, their preparation and use | BASF AKTIENGESELLSCHAFT (DE) | 1997-12-30 | — | — | US | disclosed |