Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 3/20 | 0.45 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | TGM2 | P21980 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.40 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7226405 | 1.00 | LRRK2 (0.47) | LRRK2KDRIP6K1IDO1TDO2 | |
| SCHEMBL7233945 | 0.88 | TP53 (0.43) | KDRKMT2AMAPTSMN1; SMN2PAK4 | |
| SCHEMBL7226273 | 0.88 | LRRK2 (0.48) | LRRK2KDRIP6K1IDO1TDO2 | |
| SCHEMBL7233951 | 0.88 | TP53 (0.43) | KDRKMT2AMAPTSMN1; SMN2PAK4 | |
| SCHEMBL12550474 | 0.87 | AKT2 (0.40) | LRRK2CA12CA1CA2CA9 | |
| SCHEMBL7982075 | 0.87 | PAK4 (0.43) | LRRK2KDRIP6K1CA12CA1 | |
| SCHEMBL6980872 | 0.87 | PAK4 (0.43) | LRRK2KDRIP6K1CA12CA1 | |
| SCHEMBL7224171 | 0.86 | MAPT (0.47) | LRRK2KDRIDO1TDO2TGM2 | |
| SCHEMBL7225808 | 0.86 | LRRK2 (0.43) | LRRK2KDRIDO1TDO2TGM2 | |
| SCHEMBL7225806 | 0.86 | LRRK2 (0.43) | LRRK2KDRIDO1TDO2TGM2 |
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-6545035-B1 | Having effect on various kinases and cycline/CDK complexes and on the proliferation of various tumour cells. | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2003-04-08 | — | — | US | disclosed |
| US-6319918-B1 | FOR LYMPHOMA OR SOLID TUMORS TREATMENT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-11-20 | — | — | US | disclosed |