Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | METAP2 | P50579 | 1/20 | 0.52 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10491467 | 1.00 | ALDH1A1 (0.56) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL28214437 | 0.87 | CES2 (0.56) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL39118 | 0.87 | ALDH1A1 (0.70) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL27700719 | 0.87 | ALDH1A1 (0.70) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL4967588 | 0.87 | ALDH1A1 (0.70) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL422 | 0.87 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL6112549 | 0.85 | ALDH1A1 (0.56) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| Benzoyl Chloride SCHEMBL28019438 | 0.84 | MAPT (0.56) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL8445150 | 0.84 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTTSHRHSD17B10 | |
| SCHEMBL1158413 | 0.84 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTTSHRHSD17B10 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1150565-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION bioscience AG (DE) | 2001-11-07 | — | — | EP | claimed |
| WO-2000045635-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2000-08-10 | — | — | WO | claimed |
| EP-0855997-A4 | FORMYL DERIVATIVES AS NONIONIC CONTRAST MEDIA | BIOPHYSICA INC (US) | 1998-10-07 | — | — | EP | disclosed |
| EP-0855997-A1 | FORMYL DERIVATIVES AS NONIONIC CONTRAST MEDIA | BIOPHYSICA, INC. (US) | 1998-08-05 | — | — | EP | disclosed |
| WO-1997000240-A1 | FORMYL DERIVATIVES AS NONIONIC CONTRAST MEDIA | BIOPHYSICA FOUNDATION (US) | 1997-01-03 | — | — | WO | disclosed |
| CN-1051178-A | New heterogeneous ring compound and preparation method thereof | YAMANOUCHI PHARMA CO LTD (JP) | 1991-05-08 | — | — | CN | disclosed |
| EP-0406992-A2 | New non-ionic carboxamide contrast agent | SCHERING AKTIENGESELLSCHAFT (DE) | 1991-01-09 | — | — | EP | disclosed |