Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | ELANE | P08246 | 2/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 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 | |
|---|---|---|---|---|
| SCHEMBL137047 | 0.80 | CYP19A1 (0.52) | ALDH1A1HIF1AELANELMNAATM | |
| SCHEMBL28927408 | 0.80 | ELANE (0.59) | ALDH1A1ESR1HIF1AELANELMNA | |
| SCHEMBL11467265 | 0.79 | CYP19A1 (0.50) | ALDH1A1HIF1AELANELMNAATM | |
| SCHEMBL4095285 | 0.78 | KMT2A (0.52) | ALDH1A1ESR1HIF1AELANELMNA | |
| SCHEMBL10499600 | 0.78 | RNF4 (0.57) | ALDH1A1ELANEFFAR1SMN1; SMN2HTT | |
| SCHEMBL30440320 | 0.77 | ATM (0.41) | ALDH1A1ELANELMNASMN1; SMN2ATM | |
| SCHEMBL17386333 | 0.75 | ELANE (0.49) | ALDH1A1ELANEFFAR1LMNAATM | |
| SCHEMBL9794842 | 0.75 | ALDH1A1 (0.50) | ALDH1A1ESR1HIF1AELANEFFAR1 | |
| SCHEMBL4078245 | 0.75 | KMT2A (0.54) | ELANEFFAR1SMN1; SMN2ATMKMT2A | |
| SCHEMBL1507705 | 0.74 | TDP1 (0.47) | ALDH1A1ESR1HIF1AELANELMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1845970-A4 | TUMOR NECROSIS FACTOR INHIBITORS | CEPTION THERAPEUTICS INC (US) | 2009-02-18 | — | — | EP | disclosed |
| EP-1845970-A2 | TUMOR NECROSIS FACTOR INHIBITORS | Ception Therapeutics, Inc. (US) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006083970-A2 | TUMOR NECROSIS FACTOR INHIBITORS | CEPTION THERAPEUTICS, INC. (US) | 2006-08-10 | — | — | WO | disclosed |