Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | NCF1 | P14598 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL48986 | 0.80 | PRSS1 (0.57) | NOS1NOS3NOS2LOXL2F10 | |
| SCHEMBL20880151 | 0.77 | LOXL2 (0.64) | NOS1NOS3NOS2LOXL2F10 | |
| SCHEMBL2504209 | 0.73 | KDM4E (0.68) | NOS1NOS3NOS2LOXL2KDM4E | |
| SCHEMBL25910898 | 0.73 | ALDH1A1 (0.42) | LOXL2F10ALDH1A1LMNACYP1A2 | |
| SCHEMBL22872694 | 0.72 | NOS1 (0.52) | NOS1NOS3NOS2LOXL2KDM4E | |
| SCHEMBL16181585 | 0.72 | NOS1 (0.52) | NOS1NOS3NOS2LOXL2KDM4E | |
| SCHEMBL3882642 | 0.72 | PLA2G10 (0.57) | NOS1NOS3NOS2LOXL2KDM4E | |
| SCHEMBL4865180 | 0.72 | KDM4E (0.54) | NOS1NOS3NOS2LOXL2KDM4E | |
| Hydrochloric Acid SCHEMBL30925271 | 0.71 | KDM4E (0.74) | NOS1NOS3NOS2LOXL2KDM4E | |
| Hydrochloric Acid SCHEMBL10921172 | 0.70 | KDM4E (0.44) | NOS1NOS3NOS2LOXL2KDM4E |
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-3466961-A1 | PROLINAMIDE DERIVATIVE AS THROMBIN INHIBITOR, PREPARATION METHOD AND APPLICATION THEREOF | Li, Min (US) | 2019-04-10 | — | — | EP | disclosed |