Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | MGAM | O43451 | 1/20 | 0.54 |
| ▸ | SI | P14410 | 1/20 | 0.54 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.54 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL1549737 | 0.96 | GAA (0.58) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL9859669 | 0.94 | GAA (0.52) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL28048944 | 0.94 | GAA (0.56) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL17433599 | 0.94 | GAA (0.56) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL2491946 | 0.90 | GAA (0.56) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL3777425 | 0.88 | HAO1 (0.55) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL3442509 | 0.88 | HAO1 (0.55) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL6138788 | 0.88 | HAO1 (0.55) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL6138705 | 0.88 | HAO1 (0.55) | GAAMGAMSIMGAM2FAAH | |
| SCHEMBL472723 | 0.88 | HAO1 (0.55) | GAAMGAMSIMGAM2FAAH |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6444828-B1 | BY-PRODUCT INHIBITION; REDUCTION WITH A HYDRAZINE COMPOUND,CYCLIZATION OF A 2,4-DIKETOESTER | BAYER AKTIENGESELLSCHAFT (DE) | 2002-09-03 | — | — | US | disclosed |
| US-6297386-B1 | BY REACTING THE ENOLATE OF A 2,4-DIKETOCARBOXYLIC ESTER IN THE PRESENCE OF A SOLVENT AND WATER WITH AN N-ALKYLHYDRAZINIUM SALT,PARTICULARLY ECONOMICAL PREPARATION OF AND WITH ONLY LIMITED FORMATION OF UNDESIRABLE ISOMERS. PATENT NUMBER: | BAYER AKTIENGESELLSCHAFT (DE) | 2001-10-02 | — | — | US | disclosed |
| US-5977378-A | Process for the preparation of 1-alkyl-pyrazole-5-carboxylic acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1999-11-02 | — | — | US | disclosed |
| US-5599823-A | HYPOTENSIVE AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1997-02-04 | — | — | US | disclosed |
| US-5356911-A | Hypotensive agents | BAYER AKTIENGESELLSCHAFT (DE) | 1994-10-18 | — | — | US | disclosed |