Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CTRC | Q99895 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MMP13 | P45452 | 4/20 | 0.38 |
| ▸ | MMP1 | P03956 | 3/20 | 0.38 |
| ▸ | MMP7 | P09237 | 3/20 | 0.38 |
| ▸ | MMP12 | P39900 | 3/20 | 0.38 |
| ▸ | ACE | P12821 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7971318 | 0.96 | CTRC (0.40) | TSHRTDP1L3MBTL1POLBCTRC | |
| SCHEMBL7976145 | 0.95 | TSHR (0.43) | TSHRPOLBCTRCALDH1A1MAPK1 | |
| SCHEMBL7067159 | 0.94 | TSHR (0.41) | TSHRTDP1L3MBTL1POLBCTRC | |
| SCHEMBL7969965 | 0.93 | TSHR (0.43) | TSHRPOLBCTRCALDH1A1MAPK1 | |
| SCHEMBL7972830 | 0.90 | TDP1 (0.46) | TSHRTDP1L3MBTL1POLBALDH1A1 | |
| SCHEMBL7971365 | 0.89 | KMT2A (0.40) | TSHRTDP1L3MBTL1ALDH1A1LMNA | |
| SCHEMBL7066679 | 0.89 | TSHR (0.44) | TSHRPOLBALDH1A1MAPK1CYP3A4 | |
| SCHEMBL7969622 | 0.86 | TDP1 (0.42) | TSHRTDP1L3MBTL1POLBALDH1A1 | |
| SCHEMBL7972978 | 0.86 | KMT2A (0.40) | TDP1MAPK1MMP13MMP1MMP7 | |
| SCHEMBL7973218 | 0.86 | PLA2G2C (0.40) | TSHRTDP1CTRCALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6172234-B1 | Optically active cyclic amino acid ester derivatives and processes for producing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-01-09 | — | — | US | disclosed |
| EP-0976729-A1 | Optically active cyclic amino acid ester derivatives and processes for producing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-02-02 | — | — | EP | disclosed |