Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | ADH1B | P00325 | 2/20 | 0.31 |
| ▸ | ADH1C | P00326 | 2/20 | 0.31 |
| ▸ | ADH1A | P07327 | 2/20 | 0.31 |
| ▸ | ADH7 | P40394 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | ADH4 | P08319 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11203258 | 0.91 | TSHR (0.39) | TSHRHPGDCA1CA2HCAR2 | |
| SCHEMBL10869033 | 0.81 | ATM (0.37) | ATMCYP3A4TSHRADRB2ADRB1 | |
| SCHEMBL29211176 | 0.78 | ATM (0.38) | ATMCYP3A4TSHRADRB2ADRB1 | |
| SCHEMBL27735547 | 0.77 | TSHR (0.36) | ATMCYP3A4TSHRADRB2ADRB1 | |
| SCHEMBL6511720 | 0.76 | ATM (0.37) | ATMCYP3A4TSHRADRB2ADRB1 | |
| SCHEMBL11381438 | 0.74 | ATM (0.35) | ATMCYP3A4TSHRADRB2ADRB1 | |
| SCHEMBL27735570 | 0.74 | TSHR (0.34) | ATMCYP3A4TSHRADRB2ADRB1 | |
| SCHEMBL2275108 | 0.74 | TDP1 (0.30) | ALDH1A1 | |
| SCHEMBL24829882 | 0.73 | TSHR (0.39) | TSHRHPGDCA1CA2HCAR2 | |
| SCHEMBL22776094 | 0.73 | TSHR (0.37) | ATMCYP3A4TSHRADRB2ADRB1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1167671-C | N-acylamino-acid ester and N-acylamino-acetal preparing process | BASF | 2004-09-22 | — | — | CN | disclosed |
| US-6740774-B1 | REACTING CARBOXAMIDE WITH GLYOXAL MONOACETAL DERIVATIVE | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-25 | — | — | US | disclosed |
| EP-1078916-B1 | Process for the preparation of N-acylaminoacid esters and N-acylaminoacetals | BASF AG (DE) | 2002-12-11 | — | — | EP | disclosed |
| CN-1286246-A | N-acylamino-acid ester and N-acylamino-acetal preparing process | BASF AG (DE) | 2001-03-07 | — | — | CN | disclosed |
| EP-1078916-A1 | Process for the preparation of N-acylaminoacid esters and N-acylaminoacetals | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-28 | — | — | EP | disclosed |
| EP-0146784-B1 | PROCESS FOR THE PRODUCTION OF GLYOXAL, ALKYLGLYOXALES AND OF THEIR ACETALES | Chemie Linz Gesellschaft m.b.H. (AT) | 1989-03-08 | — | — | EP | disclosed |
| US-4607126-A | Process for the preparation of glyoxal, alkylglyoxals and acetals thereof | CHEMIE LINZ AKTIENGESELLSCHAFT (AT) | 1986-08-19 | — | — | US | disclosed |
| EP-0146784-A2 | Process for the production of glyoxal, alkylglyoxales and of their acetales | Chemie Linz Gesellschaft m.b.H. (AT) | 1985-07-03 | — | — | EP | disclosed |
| EP-0036539-B1 | PROCESS FOR THE PREPARATION OF ACETALS OF METHYL GLYOXAL | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-07-27 | — | — | EP | disclosed |
| EP-0036539-A1 | Process for the preparation of acetals of methyl glyoxal | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-09-30 | — | — | EP | disclosed |