Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | CHUK | O15111 | 1/20 | 0.35 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4940386 | 0.80 | TSHR (0.46) | TSHRNPSR1HDAC4HDAC6CYP2C9 | |
| SCHEMBL22734548 | 0.69 | GAA (0.49) | TSHRNPSR1CYP2C9CYP2C19RECQL | |
| SCHEMBL17407541 | 0.68 | TSHR (0.49) | TSHRNPSR1HDAC4HDAC6CYP2C9 | |
| SCHEMBL22734518 | 0.67 | TSHR (0.46) | TSHRNPSR1CYP2C9CYP2C19RECQL | |
| SCHEMBL3400848 | 0.67 | CHRM1 (0.48) | TSHRNPSR1HDAC4HDAC6CYP2C9 | |
| SCHEMBL18896033 | 0.64 | TSHR (0.44) | TSHRNPSR1HDAC4HDAC6CYP2C9 | |
| SCHEMBL19563408 | 0.62 | SIGMAR1 (0.71) | TSHRNPSR1IKBKBCHUKNEK1 | |
| SCHEMBL4941118 | 0.62 | — | — | |
| SCHEMBL4941001 | 0.62 | POLB (0.39) | TSHRCYP2C9CYP2C19ALDH1A1POLB | |
| SCHEMBL22612184 | 0.61 | TSHR (0.56) | TSHRNPSR1HDAC4HDAC6CYP2C9 |
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-8796037-B2 | Method of detection, separation and identification for expressed trace protein/peptide | IMAI KAZUHIRO (JP) | 2014-08-05 | — | — | US | disclosed |
| US-20080280316-A1 | Mass spectrometry; liquid chromatography; automatic fractionation | IMAI KAZUHIRO | 2008-11-13 | — | — | US | disclosed |