Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.49 |
| ▸ | RAB9A | P51151 | 9/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL21096506 | 0.85 | CYP2C9 (0.47) | NPC1RAB9AMEN1KMT2ARXFP1 | |
| SCHEMBL20031275 | 0.83 | NPC1 (0.53) | NPC1RAB9AMEN1KMT2ARXFP1 | |
| SCHEMBL21061889 | 0.81 | NPC1 (0.41) | NPC1RAB9AMEN1KMT2ARXFP1 | |
| SCHEMBL20489431 | 0.81 | SMN1; SMN2 (0.45) | NPC1RAB9AMEN1KMT2ARXFP1 | |
| SCHEMBL21061845 | 0.81 | NPC1 (0.41) | NPC1RAB9AMEN1KMT2ARXFP1 | |
| SCHEMBL21061882 | 0.79 | NPC1 (0.42) | NPC1RAB9AATMPSMD14MAPK1 | |
| SCHEMBL21061808 | 0.79 | NPC1 (0.40) | NPC1RAB9AMEN1KMT2ARXFP1 | |
| SCHEMBL21061887 | 0.77 | NPC1 (0.41) | NPC1RAB9AATMPSMD14MAPK1 | |
| SCHEMBL23350442 | 0.75 | MAPK1 (0.44) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL20375538 | 0.74 | CYP2A6 (0.39) | NPC1RAB9AMEN1KMT2AATM |
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-2019116256-A1 | FUSED PYRIDINES WHICH ACT AS INHIBITORS OF H-PGDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-06-20 | — | — | WO | disclosed |