Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.39 |
| ▸ | OGA | O60502 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL20015306 | 1.00 | GRM5 (0.43) | GRM5GRM1MEN1KMT2APOLB | |
| SCHEMBL4635083 | 0.95 | GRM5 (0.46) | GRM5GRM1MEN1KMT2APOLB | |
| SCHEMBL5341383 | 0.90 | ESR2 (0.43) | GRM5GRM1MEN1KMT2APOLB | |
| SCHEMBL21369533 | 0.90 | ESR2 (0.43) | GRM5GRM1MEN1KMT2APOLB | |
| SCHEMBL5341385 | 0.90 | ESR2 (0.43) | GRM5GRM1MEN1KMT2APOLB | |
| SCHEMBL28531490 | 0.88 | MAPT (0.56) | GRM5MEN1KMT2AMAPTHPGD | |
| SCHEMBL20304926 | 0.85 | KMT2A (0.46) | GRM5MEN1KMT2AMAPTNR1H2 | |
| SCHEMBL20333548 | 0.85 | KMT2A (0.46) | GRM5MEN1KMT2AMAPTNR1H2 | |
| SCHEMBL20304927 | 0.85 | KMT2A (0.46) | GRM5MEN1KMT2AMAPTNR1H2 | |
| SCHEMBL20304919 | 0.84 | SRD5A2 (0.55) | GRM5MEN1KMT2AMAPTESR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018055096-A1 | DISUBTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES AS INHIBITORS OF MONOAMINE OXIDASE B FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | UNIVERSITY OF LJUBLJANA (SI) | 2018-03-29 | — | — | WO | disclosed |