Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP7 | P09237 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8418425 | 0.83 | TSHR (0.39) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL3355256 | 0.83 | TSHR (0.39) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL8422179 | 0.83 | TSHR (0.39) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL8420441 | 0.81 | KMT2A (0.45) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL2336327 | 0.81 | KMT2A (0.45) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL11134509 | 0.79 | ALDH1A1 (0.37) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL2997284 | 0.78 | MMP1 (0.35) | TSHRMMP1MMP2MMP3MMP7 | |
| SCHEMBL2997282 | 0.78 | MMP1 (0.35) | TSHRMMP1MMP2MMP3MMP7 | |
| SCHEMBL16310953 | 0.76 | TSHR (0.34) | TSHRMEN1KMT2AMMP1MMP2 | |
| SCHEMBL4798136 | 0.76 | SLC1A3 (0.45) | MMP1MMP2MMP3MMP7TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008006394-A1 | PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE (4E)-5- HALO-2-ALKYLPENT-4-ENOIC ACIDS AND THEIR ESTER DERIVATIVES | F.I.S. FABBRICA ITALIANA SINTETICI S.P.A (IT) | 2008-01-17 | — | — | WO | claimed |
| CN-101351548-A | Novel polypeptide having esterase activity and recombinant esterase and use thereof | DSM FINE CHEM AUSTRIA GMBH (AT) | 2009-01-21 | — | — | CN | disclosed |
| CN-101035753-A | (4E) Process for producing (E) -5-chloro-2-isopropyl-4-pentenoate and optically active substance thereof | ASAHI GLASS CO LTD (JP) | 2007-09-12 | — | — | CN | disclosed |