Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9374240 | 0.99 | ALDH1A1 (0.46) | ALDH1A1POLBKDM4EPKMCHRM2 | |
| SCHEMBL9380415 | 0.83 | RAB9A (0.41) | ALDH1A1LMNAHTTSIGMAR1MEN1 | |
| Hydrochloric Acid SCHEMBL9374650 | 0.74 | CHRM2 (0.49) | CHRM2ADRA2ASIGMAR1MEN1KMT2A | |
| SCHEMBL9375592 | 0.72 | SIGMAR1 (0.41) | ALDH1A1CHRM2ADRA2ASIGMAR1 | |
| SCHEMBL17778852 | 0.70 | MEN1 (0.52) | ALDH1A1KDM4ECHRM2ADRA2AMEN1 | |
| SCHEMBL17778986 | 0.68 | CHRM2 (0.48) | CHRM2ADRA2ASIGMAR1 | |
| SCHEMBL17778974 | 0.68 | MEN1 (0.53) | ALDH1A1KDM4ECHRM2MEN1MAPT | |
| SCHEMBL15355355 | 0.68 | ALDH1A1 (0.43) | ALDH1A1CHRM2ADRA2AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9374939 | 0.67 | OPRM1 (0.43) | ALDH1A1SIGMAR1MEN1KMT2A | |
| SCHEMBL24926025 | 0.67 | ALDH1A1 (0.43) | ALDH1A1POLBKDM4ECHRM2ADRA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0336228-B1 | Tetrahydroisoquinolines and tetrahydrobenzazepines and a process for the preparation thereof | FUJISAWA PHARMACEUTICAL CO (JP) | 1994-11-09 | — | — | EP | disclosed |
| US-5059608-A | Anticonvulsants, antiischemic agents | FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) | 1991-10-22 | — | — | US | disclosed |
| EP-0336228-A1 | Tetrahydroisoquinolines and tetrahydrobenzazepines and a process for the preparation thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1989-10-11 | — | — | EP | disclosed |