Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 8/20 | 0.47 |
| ▸ | KDM1B | Q8NB78 | 5/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL30871762 | 0.83 | KDM1A (0.47) | KDM1AKDM1BKCNH2CYP1A2CYP2D6 | |
| SCHEMBL14292894 | 0.82 | KDM1A (0.39) | KDM1AKDM1BKCNH2GABRA1GABRB2 | |
| SCHEMBL13898962 | 0.81 | NOS3 (0.40) | NOS3NOS1NOS2TSHRNPSR1 | |
| SCHEMBL22664895 | 0.81 | KDM1A (0.50) | KDM1AKDM1BKCNH2CYP1A2ALDH1A1 | |
| SCHEMBL18784110 | 0.81 | KDM1A (0.46) | KDM1AKDM1BKCNH2CYP1A2CYP2D6 | |
| SCHEMBL31414094 | 0.81 | KDM1A (0.46) | KDM1AKDM1BKCNH2ALDH1A1 | |
| SCHEMBL27918435 | 0.80 | KDM1A (0.42) | KDM1AKDM1BKCNH2 | |
| SCHEMBL17244913 | 0.79 | ALDH1A1 (0.39) | NOS3NOS1NOS2TSHRLMNA | |
| SCHEMBL15250021 | 0.79 | NOS3 (0.39) | NOS3NOS1NOS2TSHRNPSR1 | |
| SCHEMBL23490846 | 0.79 | KDM1A (0.41) | KDM1AKDM1BTSHRNPSR1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013025733-A1 | LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | INTERMUNE, INC. (US) | 2013-02-21 | — | — | WO | disclosed |