Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 4/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6971402 | 0.88 | ALDH1A1 (0.43) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL6970445 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL6972808 | 0.76 | ALDH1A1 (0.42) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL892545 | 0.73 | ALDH1A1 (0.54) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL14261164 | 0.72 | ALDH1A1 (0.53) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL9548360 | 0.72 | ALDH1A1 (0.53) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL9296882 | 0.72 | ALDH1A1 (0.53) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL892104 | 0.71 | ALDH1A1 (0.58) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL6796701 | 0.70 | ALDH1A1 (0.42) | ALDH1A1HTTL3MBTL1POLBCYP3A4 | |
| SCHEMBL17490886 | 0.69 | ALDH1A1 (0.50) | ALDH1A1HTTL3MBTL1POLBCYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | disclosed |
| US-6011028-A | Cyclic amidino agents useful as nitric oxide synthase inhibitors | G.D. SEARLE & CO. (US) | 2000-01-04 | — | — | US | disclosed |
| EP-0821674-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996033175-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1996-10-24 | — | — | WO | disclosed |