Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 2/20 | 0.37 |
| ▸ | ALPI | P09923 | 2/20 | 0.37 |
| ▸ | VCAM1 | P19320 | 8/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2050119 | 0.83 | TDP1 (0.39) | ALPLALPIVCAM1TDP1TSHR | |
| SCHEMBL6816439 | 0.81 | ALDH1A1 (0.50) | TDP1TSHRALDH1A1CYP1A2MAPK1 | |
| SCHEMBL9312984 | 0.74 | S1PR4 (0.41) | ALPLALPIVCAM1TSHR | |
| SCHEMBL13011352 | 0.72 | TPMT (0.52) | VCAM1TSHRALDH1A1MAPK1 | |
| SCHEMBL11056346 | 0.72 | TSHR (0.55) | VCAM1TDP1TSHRALDH1A1CYP1A2 | |
| SCHEMBL5041429 | 0.70 | GPR35 (0.53) | VCAM1TDP1TSHRALDH1A1CYP1A2 | |
| SCHEMBL2049113 | 0.70 | CYP1A2 (0.42) | VCAM1TDP1TSHRALDH1A1CYP1A2 | |
| SCHEMBL17744425 | 0.69 | ALDH1A1 (0.47) | TDP1TSHRALDH1A1MAPK1F2 | |
| SCHEMBL17355705 | 0.69 | CA1 (0.45) | ALPLALPITSHRALDH1A1CYP1A2 | |
| SCHEMBL29156239 | 0.69 | CYP1A2 (0.53) | TDP1TSHRALDH1A1CYP1A2MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003039456-A2 | PROCESS FOR THE PREPARATION OF ANILINE-DERIVED THYROID RECEPTOR LIGANDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-05-15 | — | — | WO | disclosed |