Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 6/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 6/20 | 0.40 |
| ▸ | HTR2C | P28335 | 5/20 | 0.40 |
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | HTR1B | P28222 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7920434 | 0.86 | MCHR1 (0.45) | MCHR1SIGMAR1HTR2AHTR2CHTR1D | |
| Hydrochloric Acid SCHEMBL7913382 | 0.83 | HTR1D (0.38) | SIGMAR1HTR2AHTR2CHTR1DHTR1B | |
| SCHEMBL7920441 | 0.80 | MCHR1 (0.45) | MCHR1SIGMAR1HTR2AHTR2CHTR1D | |
| SCHEMBL7448433 | 0.77 | HTR1D (0.54) | SIGMAR1HTR2AHTR2CHTR1DHTR1B | |
| Oxalic Acid SCHEMBL7919983 | 0.77 | HSD17B10 (0.33) | SIGMAR1HTR2AHTR2CHTR1DHTR1B | |
| SCHEMBL7439830 | 0.72 | HTR1D (0.68) | MCHR1SIGMAR1HTR2AHTR2CHTR1D | |
| SCHEMBL6921901 | 0.72 | HTR1D (0.75) | MCHR1SIGMAR1HTR2AHTR2CHTR1D | |
| SCHEMBL7067303 | 0.71 | HTR1D (0.74) | MCHR1SIGMAR1HTR2AHTR2CHTR1D | |
| SCHEMBL7920436 | 0.68 | MCHR1 (0.43) | MCHR1SIGMAR1HTR2AHTR2CHTR1D | |
| Oxalic Acid SCHEMBL7921698 | 0.67 | HTR1D (0.46) | SIGMAR1HTR2AHTR2CHTR1DHTR1B |
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-1001766-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2001-04-04 | — | — | EP | disclosed |
| EP-1001766-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999001127-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-01-14 | — | — | WO | disclosed |