Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 2/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9198675 | 0.82 | HTR2A (0.51) | SLC9A1CACNA1DALDH1A1TSHRKMT2A | |
| SCHEMBL7975868 | 0.82 | HTR2A (0.51) | SLC9A1CACNA1DALDH1A1TSHRKMT2A | |
| SCHEMBL9198668 | 0.82 | HTR2A (0.51) | SLC9A1CACNA1DALDH1A1TSHRKMT2A | |
| SCHEMBL15715833 | 0.82 | HTR2A (0.51) | SLC9A1CACNA1DALDH1A1TSHRKMT2A | |
| SCHEMBL8332475 | 0.78 | HTR2C (0.58) | SLC9A1ALDH1A1KDM4EDDB1CRBN | |
| SCHEMBL8333226 | 0.77 | SLC9A1 (0.47) | SLC9A1CACNA1DCACNA1FCACNA1SCACNA1C | |
| SCHEMBL8098211 | 0.76 | MTNR1A (0.43) | SLC9A1CACNA1DCACNA1FCACNA1SCACNA1C | |
| SCHEMBL8098209 | 0.76 | MTNR1A (0.43) | SLC9A1CACNA1DCACNA1FCACNA1SCACNA1C | |
| SCHEMBL8103541 | 0.75 | MTNR1B (0.50) | MTNR1AMTNR1B | |
| SCHEMBL8103536 | 0.75 | MTNR1B (0.50) | MTNR1AMTNR1B |
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-5889031-A | CONTROLLING CIRCADIAN RHYTHMS | BRISTOL-MYERS SQUIBB COMPNAY (US) | 1999-03-30 | — | — | US | disclosed |
| US-5753709-A | N-acyl-2 aryl cyclopropylmethylamine derivatives as melatonergics | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-05-19 | — | — | US | disclosed |