Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29023403 | 0.95 | TSHR (0.66) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Dibutyl Phthalate SCHEMBL27969431 | 0.94 | TSHR (0.64) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Dibutyl Sebacate SCHEMBL27647862 | 0.90 | TSHR (0.69) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 1,3-Butanediol SCHEMBL10725021 | 0.89 | TSHR (0.52) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| 1,4-Butanediol SCHEMBL3175914 | 0.89 | TSHR (0.76) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Adipic Acid SCHEMBL10398044 | 0.86 | ALDH1A1 (0.73) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Adipic Acid SCHEMBL28857655 | 0.86 | ALDH1A1 (0.73) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| SCHEMBL10790805 | 0.86 | TSHR (0.55) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| SCHEMBL11774105 | 0.86 | ALDH1A1 (0.51) | TSHRTDP1L3MBTL1MAPK1CYP3A4 | |
| Dibutyl Phthalate SCHEMBL11523616 | 0.86 | TSHR (0.81) | TSHRTDP1L3MBTL1MAPK1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0219284-B1 | Process for the preparation of an esterification and/or ester interchange catalyst | Research Development Corporation of Japan (JP) | 1990-10-03 | — | — | EP | disclosed |
| US-4705764-A | Esterification and/or ester interchange catalyst | RESEARCH DEVELOPMENT CORPORATION OF JAPAN (JP) | 1987-11-10 | — | — | US | disclosed |