Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL247624 | 0.85 | KMT2A (0.46) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL30628250 | 0.85 | KMT2A (0.46) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL246875 | 0.84 | TSHR (0.40) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL249487 | 0.80 | CNR2 (0.46) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL245602 | 0.80 | ABCB11 (0.44) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL18106959 | 0.77 | LMNA (0.37) | KMT2ALMNA | |
| SCHEMBL38656523 | 0.69 | CNR2 (0.41) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL5764028 | 0.69 | NPSR1 (0.38) | KMT2ATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL5010275 | 0.67 | PIN1 (0.53) | KMT2ATSHRPOLBNPSR1LMNA | |
| SCHEMBL1550807 | 0.67 | LMNA (0.41) | KMT2ACYP1A2CYP3A4PPARAPOLB |
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-2313407-A1 | cMET INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2011-04-27 | — | — | EP | disclosed |
| WO-2010019899-A1 | cMET INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-02-18 | — | — | WO | disclosed |