Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRB3 | P28472 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14039851 | 0.83 | CYP2C9 (0.38) | GABRB3CYP1A2CYP2C19CYP2C9MEN1 | |
| SCHEMBL16200262 | 0.82 | NOTUM (0.33) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL17468326 | 0.80 | RAB9A (0.40) | GABRB3GABRA2GABRB2ALDH1A1POLB | |
| SCHEMBL13683111 | 0.79 | OPRL1 (0.34) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL14039840 | 0.79 | MEN1 (0.31) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL19635907 | 0.78 | IDO1 (0.33) | IDO1 | |
| SCHEMBL739581 | 0.75 | MEN1 (0.34) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL14039578 | 0.74 | P2RX7 (0.35) | ALDH1A1POLB | |
| SCHEMBL14039838 | 0.74 | — | — | |
| SCHEMBL14039564 | 0.73 | MAPK8 (0.36) | PKMALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-7435831-B2 | Bicyclic and bridged nitrogen heterocycles | CHEMOCENTRYX, INC. (US) | 2008-10-14 | — | — | US | disclosed |