Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | TGM2 | P21980 | 5/20 | 0.39 |
| ▸ | F13A1 | P00488 | 1/20 | 0.39 |
| ▸ | TGM1 | P22735 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL9825275 | 0.83 | ALDH1A1 (0.51) | ALDH1A1KMT2AHPGDHSD17B10MEN1 | |
| SCHEMBL7138305 | 0.83 | CASP1 (0.41) | ALDH1A1KMT2ACASP1L3MBTL1HPGD | |
| SCHEMBL7448373 | 0.83 | SMPD2 (0.43) | ALDH1A1KMT2ACASP1L3MBTL1HPGD | |
| SCHEMBL7142898 | 0.83 | SMPD2 (0.43) | ALDH1A1KMT2ACASP1L3MBTL1HPGD | |
| SCHEMBL8755316 | 0.79 | EPHX1 (0.38) | ALDH1A1KMT2ATGM2L3MBTL1HPGD | |
| SCHEMBL9826662 | 0.77 | TGM2 (0.53) | ALDH1A1TGM2CASP1HPGDCYP1A2 | |
| SCHEMBL7285371 | 0.77 | MME (0.46) | ALDH1A1KMT2ATGM2CASP1HPGD | |
| SCHEMBL7285383 | 0.77 | MME (0.46) | ALDH1A1KMT2ATGM2CASP1HPGD | |
| SCHEMBL7283447 | 0.76 | CASP1 (0.39) | ALDH1A1KMT2ACASP1L3MBTL1HPGD | |
| SCHEMBL4934726 | 0.76 | TGM2 (0.44) | ALDH1A1TGM2CASP1HPGDCYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0237082-B1 | 3,5-DISUBSTITUTED 4,5-DIHYDROISOXAZOLES AS TRANSGLUTAMINASE INHIBITORS | SYNTEX (U.S.A.) INC. (US) | 1991-05-29 | — | — | EP | disclosed |
| US-4929630-A | SKIN DISORDERS, ACNE, 4,5-DIHYDROISOOXAZOLE PEPTIDES | SYNTEX (U.S.A.) INC. (US) | 1990-05-29 | — | — | US | disclosed |
| US-4912120-A | Containing amine and amide substitution | SYNTEX (U.S.A.) INC. (US) | 1990-03-27 | — | — | US | disclosed |
| EP-0237082-A2 | 3,5-disubstituted 4,5-dihydroisoxazoles as transglutaminase inhibitors | SYNTEX (U.S.A.) INC. (US) | 1987-09-16 | — | — | EP | disclosed |