Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | PTPRB | P23467 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CETP | P11597 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 1/20 | 0.36 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5156830 | 0.87 | TSHR (0.47) | SLC7A5SMN1; SMN2CYP3A4CYP2C19RAB9A | |
| SCHEMBL6209618 | 0.87 | L3MBTL1 (0.47) | SLC7A5SMN1; SMN2MEN1KMT2APOLB | |
| SCHEMBL5152783 | 0.72 | L3MBTL1 (0.44) | SMN1; SMN2MEN1KMT2ATSHR | |
| SCHEMBL6208886 | 0.72 | L3MBTL1 (0.47) | SMN1; SMN2MEN1KMT2APOLBRAB9A | |
| SCHEMBL30692683 | 0.70 | SLC7A5 (0.55) | SLC7A5MEN1KMT2ARAB9ATSHR | |
| SCHEMBL750022 | 0.70 | TSHR (0.51) | SLC7A5SMN1; SMN2MEN1KMT2ARAB9A | |
| SCHEMBL74878 | 0.70 | SLC7A5 (0.55) | SLC7A5MEN1KMT2ARAB9ATSHR | |
| SCHEMBL2482103 | 0.69 | POLB (0.46) | POLBTSHR | |
| SCHEMBL27516923 | 0.68 | TSHR (0.53) | SLC7A5SMN1; SMN2MEN1KMT2ATSHR | |
| SCHEMBL8493070 | 0.67 | KMT2A (0.41) | MEN1KMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1189612-A4 | VLA-4 INHIBITOR COMPOUNDS | DAIICHI SEIYAKU CO (JP) | 2005-02-16 | — | — | EP | disclosed |
| EP-1189612-A1 | VLA-4 INHIBITOR COMPOUNDS | Daiichi Pharmaceutical Co., Ltd. (JP) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001000206-A1 | VLA-4 INHIBITOR COMPOUNDS | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2001-01-04 | — | — | WO | disclosed |