Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | AGXT | P21549 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4995796 | 0.79 | IDO1 (0.64) | IDO1AGXTHTTUSP2GAA | |
| SCHEMBL11861626 | 0.79 | IDO1 (0.48) | IDO1AGXTKCNH2HTTUSP2 | |
| SCHEMBL29076404 | 0.79 | ALDH1A1 (0.41) | GAARAB9ASMN1; SMN2KMT2AMAOB | |
| SCHEMBL394787 | 0.78 | TSHR (0.61) | IDO1AGXTSMN1; SMN2CA1CA2 | |
| SCHEMBL77608 | 0.78 | KCNH2 (0.50) | IDO1AGXTKCNH2HTTUSP2 | |
| SCHEMBL7860410 | 0.77 | CYP3A4 (0.55) | IDO1AGXTMAOBNR4A2MAOA | |
| SCHEMBL8995755 | 0.77 | IDO1 (0.61) | IDO1AGXTHTTUSP2GAA | |
| SCHEMBL3328213 | 0.76 | IDO1 (0.54) | IDO1AGXTHTTUSP2GAA | |
| SCHEMBL8816 | 0.74 | IDO1 (0.52) | IDO1AGXTKMT2AMAOBAPP | |
| SCHEMBL6140815 | 0.73 | IDO1 (0.58) | IDO1RAB9ANPSR1MAOBMAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0456514-B1 | 2-Fluoroneplanocin A and its production | ASAHI CHEMICAL IND (JP) | 1994-10-19 | — | — | EP | claimed |
| EP-0456514-A1 | 2-Fluoroneplanocin A and its production | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1991-11-13 | — | — | EP | claimed |
| US-6504046-B1 | Cyclization of nitriles using acids, to form oxazolinone chemical intermediates such as 2-phenyl-4-isopropyl-4-methyl-1,3-oxazol-5-one, used as fungicides | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 2003-01-07 | — | — | US | disclosed |
| EP-1092705-A1 | PROCESS FOR THE PREPARATION OF AMIDES | IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) | 2001-04-18 | — | — | EP | disclosed |
| EP-0456514-B1 | 2-Fluoroneplanocin A and its production | ASAHI CHEMICAL IND (JP) | 1994-10-19 | — | — | EP | disclosed |
| EP-0456514-A1 | 2-Fluoroneplanocin A and its production | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1991-11-13 | — | — | EP | disclosed |