Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.39 |
| ▸ | SELE | P16581 | 1/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL12474471 | 0.86 | LTA4H (0.57) | MEN1KMT2AALDH1A1MAPTTDP1 | |
| SCHEMBL10999189 | 0.85 | TEAD4 (0.54) | MEN1KMT2ATEAD4ALDH1A1POLB | |
| SCHEMBL5583654 | 0.83 | TEAD4 (0.57) | MEN1KMT2ATEAD4ALDH1A1POLB | |
| SCHEMBL17527050 | 0.83 | NR4A1 (0.42) | MEN1KMT2AALDH1A1MAPTTDP1 | |
| SCHEMBL17527030 | 0.83 | TSHR (0.44) | MEN1KMT2AALDH1A1MAPTTDP1 | |
| SCHEMBL4867071 | 0.81 | CAMK2A (0.54) | ALDH1A1GAACYP3A4LTA4HHSD17B10 | |
| SCHEMBL14283765 | 0.81 | MAOB (0.53) | MEN1KMT2ATEAD4ALDH1A1POLB | |
| SCHEMBL17506817 | 0.81 | CYP3A4 (0.43) | MEN1KMT2AALDH1A1POLBMAPT | |
| SCHEMBL17498442 | 0.80 | CA14 (0.44) | MEN1KMT2AALDH1A1POLBMAPT | |
| SCHEMBL9715074 | 0.79 | MEN1 (0.56) | MEN1KMT2AALDH1A1MAPTGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2536726-B1 | DIARYL ETHER LINKED PYRROLO [2,1-C][1,4]BENZODIAZEPINE HYBRIDS AND PROCESS FOR THE PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2015-03-04 | — | — | EP | disclosed |