Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 7/20 | 0.35 |
| ▸ | NPC1 | O15118 | 6/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5201529 | 0.81 | NR1H2 (0.43) | SMN1; SMN2CASP3CASP7CASP8RAB9A | |
| SCHEMBL5200864 | 0.79 | ADORA2A (0.33) | — | |
| SCHEMBL5199693 | 0.79 | MAPT (0.34) | MAPTALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL3558612 | 0.78 | NOS2 (0.37) | SMN1; SMN2CASP3CASP7CASP8RAB9A | |
| SCHEMBL3065517 | 0.70 | MAPT (0.54) | SMN1; SMN2RAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL1228518 | 0.68 | BAZ2A (0.52) | SMN1; SMN2CASP3CASP7CASP8RAB9A | |
| SCHEMBL24980831 | 0.68 | CASP3 (0.47) | SMN1; SMN2CASP3CASP7CASP8RAB9A | |
| SCHEMBL8219214 | 0.67 | SMN1; SMN2 (0.52) | SMN1; SMN2CASP3CASP7CASP8RAB9A | |
| Bromide SCHEMBL5061856 | 0.67 | BAZ2A (0.51) | SMN1; SMN2CASP3CASP7CASP8RAB9A | |
| SCHEMBL4641452 | 0.67 | SCN10A (0.35) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1817030-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | Kalypsys, Inc. (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006060424-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | KALYPSYS, INC. (US) | 2006-06-08 | — | — | WO | disclosed |