Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 1/20 | 0.74 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.62 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.62 |
| ▸ | HTR1D | P28221 | 2/20 | 0.58 |
| ▸ | HTR6 | P50406 | 2/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | HTR1E | P28566 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 1/20 | 0.55 |
| ▸ | HTR5A | P47898 | 1/20 | 0.55 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Deboxamet SCHEMBL186946 | 1.00 | AKR1C2 (0.74) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL8270880 | 0.90 | AKR1C2 (0.74) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL8110763 | 0.87 | AKR1C2 (0.70) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL8401335 | 0.87 | AKR1C2 (0.70) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL30604527 | 0.86 | AKR1C2 (0.78) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL6825151 | 0.86 | AKR1C2 (0.78) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL7960856 | 0.85 | AKR1C2 (0.67) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| Deschlorobenzoyl Indomethacin SCHEMBL454792 | 0.85 | AKR1C2 (1.00) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL10205891 | 0.85 | AKR1C2 (0.80) | AKR1C2MTNR1AMTNR1BHTR1DHTR6 | |
| SCHEMBL4825986 | 0.85 | AKR1C2 (0.57) | AKR1C2MTNR1AMTNR1BHDAC1HDAC3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116157404-A | Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof | 诺华股份有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-114884565-B | Large-scale low-orbit satellite network topology optimization method based on communication performance constraint | 南京大学 | 2023-05-09 | — | — | CN | disclosed |
| CN-114884565-A | Communication performance constraint-based large-scale low-orbit satellite network topology optimization method | 南京大学 | 2022-08-09 | — | — | CN | disclosed |
| CN-114716544-A | Complement component C5 antibody | 阿勒根公司 | 2022-07-08 | — | — | CN | disclosed |
| US-20220047505-A1 | Controlled Absorption Water-Soluble Pharmaceutically Active Organic Compound Formulation for Once-Daily Administration | STI PHARMA, LLC (US) | 2022-02-17 | — | — | US | disclosed |