Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | FLT4 | P35916 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8812171 | 0.90 | KMT2A (0.53) | KMT2AMAPTMAPK1TDP1POLB | |
| SCHEMBL7544426 | 0.80 | HPGD (0.42) | MAPTPOLBALDH1A1TP53GAA | |
| SCHEMBL8800986 | 0.78 | RECQL (0.48) | KMT2AMAPK1POLBALDH1A1TP53 | |
| SCHEMBL8804801 | 0.76 | RECQL (0.46) | KMT2APOLBALDH1A1TP53HTT | |
| SCHEMBL752917 | 0.75 | KMT2A (0.72) | KMT2AMAPTMAPK1TDP1POLB | |
| SCHEMBL7546982 | 0.74 | SCN10A (0.36) | KMT2AMAPTMAPK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8805528 | 0.73 | MAPK14 (0.40) | KMT2AMAPTMAPK1SMN1; SMN2 | |
| SCHEMBL7548664 | 0.73 | KEAP1 (0.36) | POLBALDH1A1FLT1FLT4KDR | |
| SCHEMBL8305642 | 0.73 | KMT2A (0.54) | KMT2AMAPTMAPK1TDP1POLB | |
| SCHEMBL7549390 | 0.73 | ALDH1A1 (0.50) | KMT2APOLBALDH1A1GAAMEN1 |
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-1997049708-A9 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | — | 1998-05-22 | — | — | WO | disclosed |
| EP-0811008-A1 | BICYCLIC BENZAZEPINE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | American Cyanamid Company (US) | 1997-12-10 | — | — | EP | disclosed |