Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | AR | P10275 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4918581 | 0.90 | KMT2A (0.40) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL4913965 | 0.89 | KMT2A (0.39) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL5351989 | 0.87 | ALDH1A1 (0.43) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL4920883 | 0.87 | KMT2A (0.38) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL6465908 | 0.85 | ALDH1A1 (0.71) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL6466270 | 0.83 | AR (0.63) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL6464376 | 0.82 | KMT2A (0.51) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL4918939 | 0.80 | KMT2A (0.48) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL24411089 | 0.79 | KMT2A (0.47) | KMT2AALDH1A1POLBLMNAMEN1 | |
| SCHEMBL6467825 | 0.79 | KMT2A (0.47) | KMT2AALDH1A1POLBLMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |
| WO-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |