Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 13/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CCR5 | P51681 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5193648 | 0.82 | POLB (0.53) | NPC1RAB9ATP53MAPTHPGD | |
| SCHEMBL5191591 | 0.80 | TP53 (0.53) | CCR2KCNH2NPC1RAB9AMEN1 | |
| SCHEMBL5193199 | 0.80 | MAPT (0.55) | CCR2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL5210355 | 0.78 | CCR2 (0.50) | CCR2KCNH2NPC1RAB9AMEN1 | |
| SCHEMBL5193560 | 0.78 | CCR2 (0.48) | CCR2KCNH2MEN1KMT2ALMNA | |
| SCHEMBL5193950 | 0.76 | CCR2 (0.46) | CCR2KCNH2MEN1KMT2ACCR5 | |
| SCHEMBL5192584 | 0.76 | CCR3 (0.51) | CCR2KCNH2MEN1KMT2ACCR5 | |
| SCHEMBL5190802 | 0.76 | CCR2 (0.47) | CCR2KCNH2MEN1KMT2ACCR5 | |
| SCHEMBL1944478 | 0.75 | NPC1 (0.73) | CCR2KCNH2NPC1RAB9AMEN1 | |
| Hydrochloric Acid SCHEMBL1943329 | 0.74 | NPC1 (0.71) | CCR2KCNH2NPC1RAB9AMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0968206-B8 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX INC (US) | 2007-01-24 | — | — | EP | disclosed |
| EP-0968206-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037079-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1998-08-27 | — | — | WO | disclosed |