Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12640358 | 0.80 | CYP2C9 (0.43) | NAMPTCYP2C9HDAC1ALDH1A1ADORA2B | |
| SCHEMBL4054709 | 0.79 | LMNA (0.59) | LMNACYP2C9ALDH1A1KMT2ACYP2D6 | |
| SCHEMBL2599996 | 0.78 | ADORA2B (0.41) | NAMPTCYP2C9ALDH1A1ADORA2BPDPK1 | |
| SCHEMBL16709818 | 0.76 | LMNA (0.49) | LMNANAMPTALDH1A1KMT2AKDM4E | |
| SCHEMBL12675604 | 0.74 | PDPK1 (0.38) | NOS1NAMPTCYP2C9CYP11B1CYP11B2 | |
| SCHEMBL17568760 | 0.73 | NOS1 (0.41) | NOS1LMNANAMPTCYP2C9CYP11B1 | |
| SCHEMBL12640370 | 0.72 | PDPK1 (0.37) | NOS1NAMPTCYP2C9ALDH1A1ADORA2B | |
| SCHEMBL30775165 | 0.71 | NAMPT (0.45) | NOS1NAMPTCYP2C9CYP11B1CYP11B2 | |
| SCHEMBL10483931 | 0.70 | NOS1 (0.51) | NOS1NAMPTCYP2C9CYP11B1CYP11B2 | |
| SCHEMBL7981783 | 0.70 | NOS1 (0.45) | NOS1NAMPTCYP2C9CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3065738-B1 | COMPOSITIONS AND METHODS FOR MODULATING FARNESOID X RECEPTORS | NOVARTIS AG (CH) | 2018-02-28 | — | — | EP | disclosed |