Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.42 |
| ▸ | TSHR | P16473 | 6/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.42 |
| ▸ | HPGD | P15428 | 7/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | POLB | P06746 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 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 | |
|---|---|---|---|---|
| SCHEMBL8990588 | 0.84 | ALDH1A1 (0.43) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL8990567 | 0.72 | ADORA2A (0.44) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL8990547 | 0.70 | KDM4E (0.47) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL2113647 | 0.60 | ALDH1A1 (1.00) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL3904525 | 0.60 | ALDH1A1 (1.00) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL20370636 | 0.59 | ALDH1A1 (1.00) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL8990692 | 0.58 | HPGD (0.47) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL7146168 | 0.57 | ALDH1A1 (0.60) | RAB9ASMN1; SMN2GAAALOX15ALDH1A1 | |
| SCHEMBL6624396 | 0.57 | ADORA2A (0.67) | ALOX15HSD17B10HPGDMAPTMAPK1 | |
| SCHEMBL5161288 | 0.57 | ADORA2A (0.77) | — |
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 |