Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 14/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10724239 | 0.91 | EPHX1 (0.48) | EPHX1ACHEALDH1A1NPC1HPGD | |
| SCHEMBL17224252 | 0.90 | ACHE (0.47) | EPHX1ACHEALDH1A1NPC1HPGD | |
| SCHEMBL10769955 | 0.86 | EPHX1 (0.39) | EPHX1ACHE | |
| SCHEMBL17175563 | 0.86 | EPHX1 (0.39) | EPHX1ACHEALDH1A1NPC1RAB9A | |
| SCHEMBL12606830 | 0.85 | NPC1 (0.43) | EPHX1ACHEALDH1A1NPC1HPGD | |
| SCHEMBL12057881 | 0.84 | PLA2G2C (0.49) | EPHX1 | |
| SCHEMBL8303799 | 0.83 | EPHX1 (0.42) | EPHX1ACHEALDH1A1NPC1HPGD | |
| SCHEMBL19145239 | 0.83 | EPHX1 (0.42) | EPHX1ACHEALDH1A1NPC1HPGD | |
| SCHEMBL8303797 | 0.83 | EPHX1 (0.42) | EPHX1ACHEALDH1A1NPC1HPGD | |
| SCHEMBL9359582 | 0.83 | ACHE (0.45) | EPHX1ACHENPC1HPGDRAB9A |
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-0789571-A4 | CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO INC (US) | 1999-04-14 | — | — | EP | disclosed |
| EP-0789571-A1 | CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE | Merck & Co., Inc. (US) | 1997-08-20 | — | — | EP | disclosed |
| WO-1996014844-A1 | CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO., INC. (US) | 1996-05-23 | — | — | WO | disclosed |