Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HBB | P68871 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17782036 | 0.94 | LMNA (0.47) | LMNAMEN1KMT2ACYP1A2MAPK1 | |
| Hydrochloric Acid SCHEMBL17782046 | 0.92 | LMNA (0.53) | LMNAMEN1KMT2ACYP1A2MAPK1 | |
| SCHEMBL29360107 | 0.80 | LMNA (0.45) | LMNAMEN1KMT2AMAPTTP53 | |
| Hydrochloric Acid SCHEMBL9239 | 0.78 | LMNA (0.50) | LMNAMEN1KMT2AMAPTTP53 | |
| SCHEMBL9716783 | 0.78 | CYP1A2 (0.37) | LMNAMEN1KMT2ACYP1A2MAPK1 | |
| Hydrochloric Acid SCHEMBL1650161 | 0.76 | LMNA (0.41) | LMNAMEN1KMT2AMAPTTP53 | |
| SCHEMBL19543354 | 0.75 | CYP1A2 (0.43) | LMNACYP1A2MAPK1ALDH1A1CA12 | |
| SCHEMBL15016045 | 0.74 | CYP1A2 (0.48) | CYP1A2MAPK1ALDH1A1CA12CA1 | |
| SCHEMBL65000 | 0.73 | CYP1A2 (0.53) | LMNAMEN1KMT2ACYP1A2MAPK1 | |
| SCHEMBL1686727 | 0.73 | CYP1A2 (0.48) | CYP1A2MAPK1CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7183307-B2 | Pyrazole-derived kinase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCROPORATED (US) | 2007-02-27 | — | — | US | disclosed |
| US-7183307-B2 | Pyrazole-derived kinase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCROPORATED (US) | 2007-02-27 | — | — | US | disclosed |