Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.61 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | PNMT | P11086 | 1/20 | 0.48 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.48 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 3/20 | 0.44 |
| ▸ | NOS2 | P35228 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL30125569 | 0.93 | — | — | |
| SCHEMBL39821 | 0.93 | — | — | |
| Bromide SCHEMBL31513721 | 0.91 | TAAR1 (0.65) | TAAR1IDO1PNMTENPP2LOXL2 | |
| Hydrochloric Acid SCHEMBL5270663 | 0.91 | TAAR1 (0.65) | TAAR1IDO1PNMTENPP2LOXL2 | |
| Dimethylamine SCHEMBL5376380 | 0.87 | TAAR1 (0.61) | TAAR1IDO1PNMTENPP2LOXL2 | |
| SCHEMBL19391340 | 0.86 | TAAR1 (0.59) | TAAR1IDO1PNMTENPP2LOXL2 | |
| SCHEMBL11699 | 0.83 | — | — | |
| Acetic Acid SCHEMBL19093084 | 0.82 | TAAR1 (0.55) | TAAR1IDO1ENPP2LOXL2CYP1A2 | |
| SCHEMBL28126458 | 0.82 | TAAR1 (0.55) | TAAR1IDO1PNMTENPP2LOXL2 | |
| Benzylamine SCHEMBL2593820 | 0.81 | LOXL2 (0.74) | TAAR1IDO1PNMTENPP2LOXL2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1754705-A2 | Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders | Genentech, Inc. (US) | 2007-02-21 | — | — | EP | claimed |