Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CASP6 | P55212 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NT5E | P21589 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL28047339 | 0.88 | ALDH1A1 (0.34) | ALDH1A1MAPTCASP6KMT2AHSD17B10 | |
| SCHEMBL3275976 | 0.65 | ALDH1A1 (0.36) | ALDH1A1CASP6KMT2AHSD17B10LMNA | |
| SCHEMBL303999 | 0.62 | HTT (0.61) | ALDH1A1KMT2ANPC1PKMPKLR | |
| SCHEMBL5184447 | 0.62 | CES1 (0.50) | ALDH1A1MAPTCASP6KMT2ALMNA | |
| SCHEMBL6442007 | 0.61 | CA1 (0.42) | ALDH1A1CASP6KMT2AHSD17B10LMNA | |
| SCHEMBL3274246 | 0.61 | ALDH1A1 (0.36) | ALDH1A1CASP6KMT2AHSD17B10LMNA | |
| SCHEMBL3063829 | 0.60 | KAT6A (0.48) | ALDH1A1MAPTKMT2ACA12CA1 | |
| SCHEMBL2781797 | 0.60 | CA12 (0.54) | ALDH1A1KMT2ALMNAGAAKDM4E | |
| SCHEMBL8188347 | 0.60 | CA12 (0.54) | ALDH1A1KMT2ALMNAGAAKDM4E | |
| SCHEMBL2986914 | 0.60 | PKM (0.66) | ALDH1A1MAPTKMT2AGAAHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101378757-A | Thiadiazole derivatives for the treatment of neuro degenerative diseases | REMYND NV (BE) | 2009-03-04 | — | — | CN | disclosed |