Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.37 |
| ▸ | CNR2 | P34972 | 3/20 | 0.37 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9405811 | 1.00 | CNR1 (0.37) | CNR1CNR2PLA2G2DNPC1SMPD1 | |
| SCHEMBL9405999 | 1.00 | CNR1 (0.37) | CNR1CNR2PLA2G2DNPC1SMPD1 | |
| SCHEMBL9405996 | 1.00 | CNR1 (0.37) | CNR1CNR2PLA2G2DNPC1SMPD1 | |
| SCHEMBL9405960 | 0.99 | NPC1 (0.37) | CNR1CNR2PLA2G2DNPC1SMPD1 | |
| SCHEMBL9405964 | 0.99 | NPC1 (0.37) | CNR1CNR2PLA2G2DNPC1SMPD1 | |
| SCHEMBL9406015 | 0.97 | CNR1 (0.39) | CNR1CNR2PLA2G2DSMPD1THRA | |
| SCHEMBL9405866 | 0.97 | CNR1 (0.39) | CNR1CNR2PLA2G2DSMPD1THRA | |
| SCHEMBL9405868 | 0.97 | CNR1 (0.39) | CNR1CNR2PLA2G2DSMPD1THRA | |
| SCHEMBL9406021 | 0.97 | CNR1 (0.39) | CNR1CNR2PLA2G2DSMPD1THRA | |
| SCHEMBL9406142 | 0.97 | CNR1 (0.39) | CNR1CNR2PLA2G2DSMPD1THRA |
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-5279764-A | Dihalogenobenzene derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-01-18 | — | — | US | disclosed |