Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADK | P55263 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 7/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8990616 | 0.88 | MAPT (0.43) | MAPTTP53RAB9ASMN1; SMN2HPGD | |
| SCHEMBL8990861 | 0.79 | KDM4E (0.43) | MAPTRAB9AHPGDKDM4EALDH1A1 | |
| SCHEMBL8990844 | 0.73 | ADORA2A (0.43) | ADKMAPTRAB9AHPGDKDM4E | |
| SCHEMBL8990609 | 0.70 | KDM4E (0.45) | MAPTHPGDKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8990648 | 0.69 | KDM4E (0.52) | MAPTTP53RAB9ASMN1; SMN2HPGD | |
| SCHEMBL9347577 | 0.66 | ADORA2A (0.67) | MAPTHPGDKDM4EALDH1A1HSD17B10 | |
| SCHEMBL1219378 | 0.66 | SIRT1 (0.44) | MAPTTP53RAB9ASMN1; SMN2HPGD | |
| SCHEMBL660603 | 0.65 | ADORA2A (0.43) | ADORA2AADORA1 | |
| SCHEMBL660601 | 0.64 | KDM4E (0.53) | MAPTSMN1; SMN2HPGDKDM4EALDH1A1 | |
| SCHEMBL1831711 | 0.61 | ERCC1 (0.38) | MAPTRAB9ANPC1POLBKMT2A |
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-5500428-A | Furyl-substituted purines and adenosine antagonists | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1996-03-19 | — | — | US | disclosed |
| US-5300509-A | Adenosine antagonists for treating cardiovascular disorders, vasodilation | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-04-05 | — | — | US | disclosed |
| EP-0544445-A2 | Furyl-substituted purines, oxazolopyrimidines and pteridines as adenosine antagonists | ZENECA LIMITED (GB) | 1993-06-02 | — | — | EP | disclosed |