Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.46 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.42 |
| ▸ | KLK1 | P06870 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.41 |
| ▸ | PTGIR | P43119 | 1/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL27789966 | 0.89 | PTGDR2 (0.56) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL4778730 | 0.89 | PTGDR2 (0.56) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL27768501 | 0.87 | PTGDR2 (0.56) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL27768505 | 0.86 | PTGDR2 (0.53) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL2010037 | 0.83 | PTGDR2 (0.72) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL27768408 | 0.83 | PTGDR2 (0.52) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL27790170 | 0.83 | PTGDR2 (0.50) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL2005637 | 0.82 | PTGDR2 (1.00) | PTGDR2CYP1A2CYP2C19P2RX7KDM4E | |
| SCHEMBL27905712 | 0.82 | PTGDR2 (0.49) | PTGDR2CYP1A2CYP2C19P2RX7KLKB1 | |
| SCHEMBL16558821 | 0.81 | PTGDR2 (0.76) | PTGDR2P2RX7KLKB1KLK1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1931632-A2 | USEFUL INDOLE COMPOUNDS | Microbia Inc. (US) | 2008-06-18 | — | — | EP | disclosed |
| WO-2007022501-A2 | USEFUL INDOLE COMPOUNDS | MICROBIA, INC. (US) | 2007-02-22 | — | — | WO | disclosed |