Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6576878 | 0.76 | KMT2A (0.59) | KMT2ASMN1; SMN2NPSR1KDM4ECNR2 | |
| SCHEMBL31483432 | 0.76 | L3MBTL1 (0.64) | KMT2ASMN1; SMN2NPSR1KDM4ECNR2 | |
| SCHEMBL2223462 | 0.74 | KMT2A (0.53) | KMT2ASMN1; SMN2NPSR1KDM4ECNR2 | |
| SCHEMBL7429475 | 0.70 | POLB (0.49) | KMT2AKDM4EPOLBPPARGPPARA | |
| SCHEMBL11002192 | 0.70 | KMT2A (0.60) | KMT2ANPSR1CNR2POLBMEN1 | |
| SCHEMBL27579668 | 0.70 | KMT2A (0.60) | KMT2ACNR2POLBPARP10ALDH1A1 | |
| SCHEMBL6576876 | 0.70 | KMT2A (0.56) | KMT2AKDM4EPOLBPARP10PPARG | |
| SCHEMBL27838831 | 0.70 | FFAR1 (0.60) | KMT2ASMN1; SMN2NPSR1KDM4ECNR2 | |
| SCHEMBL13802928 | 0.69 | SMN1; SMN2 (0.59) | KMT2ASMN1; SMN2NPSR1CNR2ALDH1A1 | |
| SCHEMBL11210075 | 0.69 | KMT2A (0.58) | KMT2ANPSR1CNR2POLBMEN1 |
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-1133484-A2 | HETEROCYCLIC DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS | AstraZeneca AB (SE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2000005223-A2 | HETEROCYCLIC DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS | ASTRAZENECA AB (SE) | 2000-02-03 | — | — | WO | disclosed |