Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.38 |
| ▸ | ERN1 | O75460 | 2/20 | 0.37 |
| ▸ | JUN | P05412 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL7263206 | 0.81 | PDGFRA (0.47) | PDGFRAPDGFRBALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL7258836 | 0.78 | KDM4E (0.52) | PDGFRAPDGFRBALDH1A1LMNAKDM4E | |
| SCHEMBL7263203 | 0.77 | PDGFRA (0.50) | PDGFRAPDGFRBALDH1A1KDRL3MBTL1 | |
| SCHEMBL7263674 | 0.77 | THRB (0.44) | PDGFRAPDGFRBRAB9AFGFR2 | |
| SCHEMBL7258379 | 0.77 | FGFR2 (0.44) | PDGFRAPDGFRBALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL9049946 | 0.76 | NFE2L2 (0.55) | TUBB1ALDH1A1CYP1A2LMNACYP2C9 | |
| SCHEMBL6693303 | 0.74 | TUBB1 (0.46) | TUBB1ALDH1A1CYP1A2LMNACYP2C9 | |
| SCHEMBL172939 | 0.73 | ALDH1A1 (0.71) | TUBB1ALDH1A1CYP1A2KDM4ETSHR | |
| SCHEMBL29392394 | 0.73 | ALDH1A1 (0.71) | TUBB1ALDH1A1CYP1A2KDM4ETSHR | |
| SCHEMBL8844762 | 0.71 | ERN1 (0.59) | TUBB1ALDH1A1CYP1A2LMNACYP2C9 |
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-2003094845-A2 | PYRIDINE-BASED THYROID RECEPTOR LIGANDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-11-20 | — | — | WO | disclosed |