Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10963674 | 0.87 | KMT2A (0.46) | ALDH1A1LMNAKMT2AMEN1KDM4E | |
| SCHEMBL10962823 | 0.81 | ALDH1A1 (0.41) | ALDH1A1KDM4EHTTSMN1; SMN2PTGDR2 | |
| SCHEMBL10962788 | 0.80 | CYP2C19 (0.47) | ALDH1A1LMNAKMT2AMEN1KDM4E | |
| SCHEMBL10737356 | 0.79 | MAPT (0.41) | ALDH1A1LMNAKMT2AMEN1KDM4E | |
| SCHEMBL10736825 | 0.70 | MAPT (0.41) | ALDH1A1LMNAKMT2AMEN1HTT | |
| SCHEMBL11914099 | 0.69 | MAPT (0.41) | ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL10738457 | 0.69 | KMT2A (0.48) | ALDH1A1LMNAKMT2AMEN1KDM4E | |
| SCHEMBL10962884 | 0.69 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL7374432 | 0.69 | ALDH1A1 (0.51) | ALDH1A1LMNAKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL11899473 | 0.68 | MAPT (0.43) | ALDH1A1LMNAKMT2AMEN1KDM4E |
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-0137993-A2 | 11-Piperazinyl-5H-imidazo[2,1-c][1,4]benzodiazepines, process for their preparation and intermediates and medicaments containing them | BOEHRINGER INGELHEIM KG (DE) | 1985-04-24 | — | — | EP | disclosed |