Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 8/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CLK1 | P49759 | 1/20 | 0.42 |
| ▸ | CLK2 | P49760 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5119970 | 0.84 | PDE5A (0.44) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL27655477 | 0.83 | TNF (0.44) | PDE5ATNFNOD1 | |
| SCHEMBL5119638 | 0.82 | CHRM4 (0.46) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL5121525 | 0.81 | ICAM1 (0.44) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL7538475 | 0.81 | PDE5A (0.41) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL5122246 | 0.80 | USP1 (0.45) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL5122516 | 0.79 | ESR1 (0.64) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL5123611 | 0.78 | PDE5A (0.47) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL5123186 | 0.77 | PDE5A (0.50) | PDE5ACLK4MEN1KMT2AALDH1A1 | |
| SCHEMBL27377633 | 0.77 | TNF (0.57) | PDE5ASMN1; SMN2TNFNOD1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1081638-C | Thienopyrimidine compounds | MERCK PATENT GMBH (DE) | 2002-03-27 | — | — | CN | disclosed |
| CN-1227560-A | Thienopyrimidines | MERCK PATENT GMBH (DE) | 1999-09-01 | — | — | CN | disclosed |