Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.32 |
| ▸ | CPT2 | P23786 | 1/20 | 0.32 |
| ▸ | ACLY | P53396 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Thioglycolic Acid SCHEMBL110271 | 0.87 | — | — | |
| Thioglycolic Acid SCHEMBL5074469 | 0.87 | TP53 (0.44) | TSHRALDH1A1TP53HSD17B10LMNA | |
| Pivalate SCHEMBL27298103 | 0.82 | TSHR (0.40) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| Thioglycolic Acid SCHEMBL27952872 | 0.79 | TP53 (0.45) | TSHRTP53HSD17B10 | |
| Thioglycolic Acid SCHEMBL8747761 | 0.79 | HMGCR (0.38) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| Thioglycolic Acid SCHEMBL4528557 | 0.78 | — | — | |
| Lactic Acid SCHEMBL28878237 | 0.76 | TP53 (0.65) | TP53 | |
| Thioglycolic Acid SCHEMBL2021002 | 0.76 | — | — | |
| Hexylene Glycol SCHEMBL11586164 | 0.75 | HMGCR (0.36) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| Propylene Glycol SCHEMBL99242 | 0.74 | TDP1 (0.56) | TSHRALDH1A1TP53LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103664606-B | A kind of preparation method of flurbiprofen ester compound | GUANGDONG JIABO PHARMACEUTICAL CO., LTD. (CN) | 2016-01-20 | — | — | CN | claimed |
| CN-103664606-A | Preparation methods of flurbiprofen axetil compound | GUANGDONG JIABO PHARMACEUTICAL CO LTD | 2014-03-26 | — | — | CN | claimed |
| CN-103664606-B | A kind of preparation method of flurbiprofen ester compound | GUANGDONG JIABO PHARMACEUTICAL CO., LTD. (CN) | 2016-01-20 | — | — | CN | disclosed |
| CN-103664606-A | Preparation methods of flurbiprofen axetil compound | GUANGDONG JIABO PHARMACEUTICAL CO LTD | 2014-03-26 | — | — | CN | disclosed |