Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DUT | P33316 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7819883 | 0.86 | ALDH1A1 (0.52) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7813412 | 0.82 | KDM4E (0.48) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7814812 | 0.80 | ALDH1A1 (0.48) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7819795 | 0.78 | KDM4E (0.57) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL3155510 | 0.77 | KDM4E (0.58) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7814637 | 0.72 | CYP1A2 (0.59) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7806581 | 0.70 | ALDH1A1 (0.56) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL3158156 | 0.69 | KDM4E (0.69) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7981421 | 0.68 | KDM4E (0.47) | ALDH1A1HSD17B10KDM4EHPGDADRA1A | |
| SCHEMBL7967624 | 0.67 | KDM4E (0.46) | ALDH1A1HSD17B10KDM4EHPGDADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| US-5017701-A | Process for the preparation of purine derivatives | BEECHAM GROUP, P.L.C. (GB) | 1991-05-21 | — | — | US | disclosed |
| EP-0352953-A2 | Process for the preparation of purine derivatives | BEECHAM GROUP PLC (GB) | 1990-01-31 | — | — | EP | disclosed |