Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | PDE5A | O76074 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 16/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 14/20 | 0.55 |
| ▸ | HPGD | P15428 | 9/20 | 0.55 |
| ▸ | GLA | P06280 | 6/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.55 |
| ▸ | GAA | P10253 | 9/20 | 0.51 |
| ▸ | RAB9A | P51151 | 9/20 | 0.51 |
| ▸ | NPC1 | O15118 | 7/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.49 |
| ▸ | GFER | P55789 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25599852 | 0.77 | ALDH1A1 (0.64) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL218827 | 0.76 | ALDH1A1 (0.62) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL10759512 | 0.75 | PDE5A (0.52) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL31197646 | 0.75 | PDE5A (0.72) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL4482685 | 0.75 | PDE5A (0.72) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL10792855 | 0.74 | KDM4E (0.53) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| Bromide SCHEMBL10794494 | 0.73 | KDM4E (0.52) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL219665 | 0.73 | ALDH1A1 (0.55) | KMT2AMEN1PDE5AALDH1A1KDM4E | |
| SCHEMBL1205852 | 0.73 | EDNRA (0.52) | ALDH1A1KDM4ERAB9APOLBCYP1A2 | |
| SCHEMBL10758052 | 0.73 | ALDH1A1 (0.51) | KMT2AMEN1PDE5AALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4636502-A | Methods of producing a positive inotropic effect or vasodilation by administration of 2-phenyl imidazo pyrimidines and pyrazines | ELI LILLY AND COMPANY (US) | 1987-01-13 | — | — | US | disclosed |
| US-4537889-A | PHENYL SUBSTITUTED IMIDAZO COMPOUNDS | ELI LILLY AND COMPANY (US) | 1985-08-27 | — | — | US | disclosed |
| EP-0113236-A1 | Substituted imidazopyrimidines-pyrazines, and -triazines | ELI LILLY AND COMPANY (US) | 1984-07-11 | — | — | EP | disclosed |