Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.40 |
| ▸ | TSPO | P30536 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28805707 | 0.83 | CHRM1 (0.54) | ALDH1A1LMNAPOLBSMN1; SMN2F2RL3 | |
| SCHEMBL997654 | 0.75 | SIGMAR1 (0.43) | ALDH1A1LMNACYP1A2CYP3A4NPSR1 | |
| SCHEMBL8966581 | 0.73 | SIGMAR1 (0.56) | MAPTALDH1A1LMNAL3MBTL1NPSR1 | |
| SCHEMBL2090257 | 0.73 | NR4A2 (0.76) | NR4A2ALDH1A1LMNACREBBPPOLB | |
| SCHEMBL7056985 | 0.70 | LMNA (0.69) | NR4A2MAPTALDH1A1LMNACREBBP | |
| SCHEMBL28026387 | 0.69 | NR4A2 (0.60) | NR4A2MAPTALDH1A1LMNACREBBP | |
| SCHEMBL28812330 | 0.69 | ALDH1A1 (0.57) | MAPTALDH1A1LMNACREBBPPOLB | |
| SCHEMBL1400828 | 0.69 | ALDH1A1 (0.63) | MAPTALDH1A1LMNAPOLBL3MBTL1 | |
| SCHEMBL11768823 | 0.68 | ALDH1A1 (0.42) | MAPTALDH1A1LMNAL3MBTL1SMN1; SMN2 | |
| SCHEMBL798421 | 0.68 | NR4A2 (0.48) | NR4A2MAPTALDH1A1LMNACREBBP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2627648-A1 | 17aHYDROXYLASE/C17,20-LYASE INHIBITORS | Novartis AG (CH) | 2013-08-21 | — | — | EP | disclosed |
| WO-2012035078-A1 | 17α-HYDROXYLASE/C17,20-LYASE INHIBITORS | NOVARTIS AG (CH) | 2012-03-22 | — | — | WO | disclosed |