Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 9/20 | 0.81 |
| ▸ | KCNK3 | O14649 | 6/20 | 0.47 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | TACR2 | P21452 | 2/20 | 0.44 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | TACR3 | P29371 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2969652 | 0.89 | CTSS (0.97) | CTSSKCNK3CREBBP | |
| SCHEMBL2972653 | 0.89 | CTSS (1.00) | CTSSKCNK3 | |
| SCHEMBL2985196 | 0.89 | CTSS (0.98) | CTSSKCNK3 | |
| SCHEMBL2981128 | 0.89 | CTSS (0.98) | CTSSKCNK3 | |
| SCHEMBL2971542 | 0.88 | CTSS (0.83) | CTSSKCNK3CREBBPCYP1A2CYP3A4 | |
| SCHEMBL2982564 | 0.86 | CTSS (0.80) | CTSSKCNK3CREBBPCYP1A2CYP3A4 | |
| SCHEMBL2972732 | 0.85 | CTSS (1.00) | CTSS | |
| SCHEMBL2981146 | 0.83 | CTSS (0.80) | CTSSKCNK3CREBBPCYP1A2CYP3A4 | |
| SCHEMBL2981144 | 0.83 | CTSS (0.80) | CTSSKCNK3CREBBPCYP1A2CYP3A4 | |
| SCHEMBL2980314 | 0.79 | CTSS (0.88) | CTSSCREBBP |
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 |
|---|---|---|---|---|---|---|---|
| US-7429591-B2 | Substituted pyrazoles | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2008-09-30 | — | — | US | claimed |