Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | STAT3 | P40763 | 1/20 | 0.44 |
| ▸ | STS | P08842 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.42 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7987106 | 0.89 | CTSD (0.46) | CTSDNPC1HPGDTP53ALDH1A1 | |
| SCHEMBL7974560 | 0.86 | HCRTR1 (0.53) | HPGDALDH1A1LMNAGLARAB9A | |
| SCHEMBL7987135 | 0.83 | CTSD (0.49) | CTSDNPC1HPGDALDH1A1STAT3 | |
| SCHEMBL7987852 | 0.83 | IRAK4 (0.54) | ALDH1A1LMNAKCNK3KCNK9 | |
| SCHEMBL7983548 | 0.82 | LMNA (0.54) | TP53ALDH1A1LMNASMN1; SMN2MAPT | |
| SCHEMBL7991056 | 0.78 | NPSR1 (0.39) | HPGDTP53ALDH1A1HTT | |
| SCHEMBL7973403 | 0.78 | ERCC5 (0.42) | NPC1HPGDRAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL7987842 | 0.77 | CES2 (0.47) | NPC1HPGDTP53ALDH1A1LMNA | |
| SCHEMBL7973190 | 0.77 | CES2 (0.47) | HPGDTP53ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7974319 | 0.77 | RAB9A (0.42) | NPC1HPGDALDH1A1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |