Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.39 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.39 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.37 |
| ▸ | GLP1R | P43220 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL185181 | 0.81 | ACLY (0.41) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL533215 | 0.78 | MCL1 (0.39) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL21999697 | 0.78 | ACLY (0.48) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL29683114 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL67766 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL66378 | 0.77 | TRPV4 (0.53) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL29907293 | 0.77 | TRPV4 (0.53) | ALDH1A1KMT2ATSHRMEN1L3MBTL1 | |
| SCHEMBL981089 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4HPGDALOX15 | |
| SCHEMBL5704866 | 0.73 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP3A4HPGDTRPV4 | |
| SCHEMBL29683254 | 0.73 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP3A4HPGDTRPV4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |