Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 10/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4886170 | 0.81 | CYP1A2 (0.38) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| SCHEMBL4894831 | 0.78 | CYP1A2 (0.47) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| SCHEMBL5310034 | 0.78 | CYP1A2 (0.41) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| SCHEMBL4886164 | 0.77 | MEN1 (0.39) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL4897081 | 0.77 | CYP1A2 (0.44) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| SCHEMBL5315126 | 0.76 | CYP1A2 (0.41) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| SCHEMBL4897407 | 0.76 | CYP1A2 (0.39) | CYP1A2CYP2C19RIPK1KMT2AMEN1 | |
| SCHEMBL14280805 | 0.75 | SCN9A (0.42) | CYP1A2CYP2C19RIPK1KMT2ACNR1 | |
| SCHEMBL8274287 | 0.74 | RIPK1 (0.41) | CYP1A2CYP2C19RIPK1CNR1CNR2 | |
| SCHEMBL4894681 | 0.69 | RIPK1 (0.37) | CYP1A2CYP2C19RIPK1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1758863-A1 | TETRAHYDROQUINOLONES AND AZA-ANALOGUES THEREOF FOR USE AS DPP-IV INHIBITORS IN THE TREATEMENT OF DIABETES | AstraZeneca AB (SE) | 2007-03-07 | — | — | EP | disclosed |
| WO-2005123685-A1 | TETRAHYDROQUINOLONES AND AZA-ANALOGUES THEREOF FOR USE AS DPP-IV INHIBITORS IN THE TREATEMENT OF DIABETES | ASTRAZENECA AB (SE) | 2005-12-29 | — | — | WO | disclosed |