Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 6/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.32 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4638481 | 0.88 | IDH1 (0.44) | P2RX7IDH1TACR1MAPTGRM2 | |
| SCHEMBL4637811 | 0.86 | GRM2 (0.36) | USP2CYP3A4CYP2D6IDH1TACR1 | |
| SCHEMBL4637948 | 0.86 | RORB (0.36) | P2RX7IDH1TACR1MAPTTHRB | |
| SCHEMBL4638051 | 0.85 | ALDH1A1 (0.39) | TACR1MAPTTHRBGRM2KDM4E | |
| SCHEMBL4637887 | 0.84 | USP2 (0.36) | P2RX7USP2CYP3A4MEN1KMT2A | |
| SCHEMBL4637984 | 0.83 | TACR1 (0.39) | P2RX7MEN1KMT2ATACR1MAPT | |
| SCHEMBL4638552 | 0.82 | TACR1 (0.40) | P2RX7TACR1MAPTTHRBGRM2 | |
| SCHEMBL4637750 | 0.81 | IDH1 (0.43) | P2RX7CYP3A4MEN1KMT2AIDH1 | |
| SCHEMBL4637712 | 0.81 | IDH1 (0.51) | P2RX7CYP3A4IDH1MAPTGRM2 | |
| SCHEMBL4706074 | 0.80 | RORB (0.39) | P2RX7USP2CYP3A4MEN1KMT2A |
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-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |