Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R | Q15722 | 1/20 | 0.48 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 4/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.39 |
| ▸ | F2 | P00734 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8306394 | 0.80 | TACR3 (0.40) | HPGDMAPTALDH1A1CYP2C9PARP1 | |
| SCHEMBL8305615 | 0.80 | CNR2 (0.46) | LTB4RLTB4R2HPGDGAAKMT2A | |
| SCHEMBL8302401 | 0.76 | GPR88 (0.40) | GAAKMT2AMAPTKDM4EALDH1A1 | |
| SCHEMBL8303022 | 0.69 | ALDH1A1 (0.46) | GAAKMT2AMAPTKDM4EALDH1A1 | |
| SCHEMBL8306001 | 0.68 | HPGD (0.49) | HPGDGAAKMT2AALDH1A1MEN1 | |
| SCHEMBL4732145 | 0.67 | LMNA (0.49) | GAACYP2C9MAPK1 | |
| SCHEMBL22502277 | 0.67 | LMNA (0.49) | GAACYP2C9MAPK1 | |
| SCHEMBL10332571 | 0.67 | LMNA (0.53) | GAAALDH1A1CYP2C9MAPK1 | |
| SCHEMBL16339449 | 0.66 | KLRK1 (0.48) | HPGDGAAKMT2AMAPTKDM4E | |
| SCHEMBL23716017 | 0.65 | LMNA (0.65) | HPGDKMT2AALDH1A1MEN1SMN1; SMN2 |
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 |