Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | PGK1 | P00558 | 2/20 | 0.34 |
| ▸ | PGK2 | P07205 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL3785333 | 0.76 | TSHR (0.50) | TSHRCYP1A2CYP3A4LMNAFAAH | |
| SCHEMBL6820234 | 0.75 | CYP1A2 (0.45) | TSHRPGK1PGK2CYP1A2CYP3A4 | |
| SCHEMBL7306133 | 0.73 | GABRA1 (0.55) | TSHRPGK1PGK2CYP1A2CYP3A4 | |
| SCHEMBL8728826 | 0.73 | TSHR (0.35) | TSHRCYP1A2CYP3A4LMNAFAAH | |
| SCHEMBL7305908 | 0.71 | ALDH1A1 (0.44) | TSHRCYP1A2CYP3A4HPGDHIF1A | |
| SCHEMBL3911665 | 0.69 | TSHR (0.38) | TSHR | |
| SCHEMBL1872442 | 0.69 | CYP1A2 (0.58) | TSHRCYP1A2CYP3A4LMNASLC6A2 | |
| SCHEMBL199413 | 0.69 | GABRA1 (0.57) | TSHRCYP1A2CYP3A4LMNAFAAH | |
| SCHEMBL5850205 | 0.67 | GABRA1 (0.33) | TSHRGABRA1GABRG2GABRB3 | |
| SCHEMBL5589720 | 0.67 | ALDH1A1 (0.52) | TSHRCYP1A2CYP3A4LMNAFAAH |
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-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |