Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | RAD52 | P43351 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8042636 | 0.90 | CYP1A2 (0.41) | MTORCRHR1PDE5A | |
| SCHEMBL4126045 | 0.86 | PDE5A (0.41) | MTORCRHR1PDE5AMEN1KMT2A | |
| SCHEMBL4130996 | 0.86 | PDE5A (0.41) | MTORCRHR1PDE5A | |
| SCHEMBL4127685 | 0.85 | PDE5A (0.51) | CRHR1PDE5AALDH1A1MEN1KMT2A | |
| SCHEMBL4137351 | 0.83 | PDE5A (0.39) | CRHR1PDE5AALDH1A1MEN1KMT2A | |
| SCHEMBL4143420 | 0.80 | CRHR1 (0.42) | MTORCRHR1PDE5AKDM4EALDH1A1 | |
| SCHEMBL4138719 | 0.78 | PDE5A (0.39) | MTORCRHR1PDE5AKDM4EALDH1A1 | |
| SCHEMBL4115556 | 0.78 | ALDH1A1 (0.41) | MTORCRHR1PDE5AKDM4EALDH1A1 | |
| SCHEMBL4136240 | 0.77 | CRHR1 (0.39) | MTORCRHR1PDE5AKDM4EALDH1A1 | |
| SCHEMBL4140332 | 0.77 | CRHR1 (0.41) | CRHR1PDE5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009071705-A1 | PYRAZOLEPYRIMIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS NV (BE) | 2009-06-11 | — | — | WO | claimed |
| WO-2009071705-A1 | PYRAZOLEPYRIMIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS NV (BE) | 2009-06-11 | — | — | WO | disclosed |