Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP1 | P22413 | 1/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 10/20 | 0.39 |
| ▸ | PDE5A | O76074 | 6/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11010396 | 0.84 | ENPP1 (0.42) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL11010246 | 0.83 | ENPP1 (0.50) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL11009501 | 0.83 | ENPP1 (0.45) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL11006136 | 0.80 | PDE2A (0.42) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL11009066 | 0.79 | ENPP1 (0.52) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL10745432 | 0.78 | CYP17A1 (0.61) | ENPP1CYP17A1 | |
| SCHEMBL11005543 | 0.78 | ENPP1 (0.46) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL11010177 | 0.78 | ENPP1 (0.46) | ENPP1PDE2ACYP17A1PDE5APDE3B | |
| SCHEMBL11237402 | 0.77 | PDE2A (0.67) | PDE2APDE5APDE3BPDE3AKDM4E | |
| SCHEMBL10765432 | 0.77 | ENPP1 (0.54) | ENPP1PDE2ACYP17A1PDE5APDE3B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0142075-A2 | Purine derivatives, their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1985-05-22 | — | — | EP | disclosed |