Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 4/20 | 0.46 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8303023 | 0.81 | CNR2 (0.49) | CNR2KMT2AHPGDMAPT | |
| SCHEMBL8303024 | 0.80 | LTB4R (0.48) | LTB4RLTB4R2KMT2AMEN1EPHX2 | |
| SCHEMBL8302507 | 0.77 | CNR2 (0.44) | CNR2KMT2AMEN1GAAHPGD | |
| SCHEMBL4566800 | 0.73 | CNR2 (0.67) | CNR2KMT2AMEN1HPGDMAPT | |
| SCHEMBL8306001 | 0.70 | HPGD (0.49) | KMT2AMEN1EPHX2GAAHPGD | |
| SCHEMBL8302373 | 0.69 | HPGD (0.48) | KMT2AMEN1GAAHPGDTSHR | |
| SCHEMBL17845065 | 0.65 | ALDH1A1 (0.51) | LTB4RLTB4R2KMT2AMEN1GAA | |
| SCHEMBL17845064 | 0.65 | ALDH1A1 (0.51) | LTB4RLTB4R2KMT2AMEN1GAA | |
| SCHEMBL1492483 | 0.65 | NPC1 (0.69) | KMT2AMEN1GAAHPGDKDM4E | |
| SCHEMBL8599235 | 0.65 | NPC1 (0.69) | KMT2AMEN1GAAHPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004085661-A2 | PROCESS TO CHIRAL BETA-AMINO ACID DERIVATIVES | MERCK & CO., INC (US) | 2004-10-07 | — | — | WO | disclosed |