Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5194854 | 0.82 | NPC1 (0.44) | NPC1RAB9AALDH1A1LMNAPOLB | |
| SCHEMBL5193913 | 0.82 | NPC1 (0.44) | NPC1RAB9AALDH1A1LMNAPOLB | |
| SCHEMBL5195403 | 0.81 | HPGD (0.42) | NPC1RAB9ALMNAMEN1KMT2A | |
| SCHEMBL5191220 | 0.79 | FAAH (0.51) | NPC1RAB9ALMNAPOLBMEN1 | |
| SCHEMBL5191129 | 0.77 | CA1 (0.46) | NPC1RAB9AALDH1A1POLBMEN1 | |
| SCHEMBL5190765 | 0.76 | CHRM1 (0.47) | NPC1RAB9AALDH1A1LMNAPOLB | |
| SCHEMBL5192010 | 0.74 | HPGD (0.46) | ALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL5193934 | 0.73 | ALDH1A1 (0.53) | ALDH1A1LMNAMEN1KMT2AHPGD | |
| SCHEMBL2917177 | 0.73 | REN (0.35) | LMNA | |
| SCHEMBL4672942 | 0.73 | RAB9A (0.74) | NPC1RAB9AALDH1A1LMNAPOLB |
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 |