Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 4/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10400096 | 0.88 | IDO1 (0.41) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL4043115 | 0.86 | GRIN2B (0.57) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL10398507 | 0.85 | CA1 (0.56) | GRIN2BCA1CA2HDAC8HDAC6 | |
| Hydrochloric Acid SCHEMBL4053518 | 0.84 | GRIN2B (0.56) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL28583286 | 0.80 | CA1 (0.48) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL24427605 | 0.78 | GRM5 (0.46) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL30479468 | 0.77 | GRIN2B (0.54) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL29033596 | 0.77 | GRIN2B (0.54) | MTNR1AMTNR1BGRIN2BCA1CA2 | |
| SCHEMBL10399768 | 0.77 | TAOK1 (0.55) | GRIN2BSIGMAR1 | |
| SCHEMBL10399462 | 0.77 | CYP26A1 (0.58) | MTNR1AMTNR1BGRIN2BCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4975461-A | Enzymes/oxidoreductases/inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1990-12-04 | — | — | US | claimed |
| US-4975461-A | Enzymes/oxidoreductases/inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1990-12-04 | — | — | US | disclosed |