Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.31 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11335046 | 0.91 | DRD2 (0.37) | TSHRACHECA4DRD2DRD4 | |
| SCHEMBL11704235 | 0.87 | TSHR (0.38) | TSHRACHECA4LTA4HDRD2 | |
| SCHEMBL8939006 | 0.85 | LTA4H (0.35) | TSHRACHECA4LTA4HDRD2 | |
| SCHEMBL14605205 | 0.82 | TSHR (0.33) | TSHRACHECA4LTA4HCYP3A4 | |
| SCHEMBL11402161 | 0.79 | NPC1 (0.36) | TSHRCA4LTA4HDRD2DRD4 | |
| SCHEMBL4581422 | 0.78 | ACHE (0.38) | TSHRACHECA4LTA4HDRD2 | |
| SCHEMBL30605004 | 0.78 | TSHR (0.41) | TSHRACHEALDH1A1NPC1RAB9A | |
| SCHEMBL1726390 | 0.78 | TSHR (0.41) | TSHRACHEALDH1A1NPC1RAB9A | |
| SCHEMBL2415290 | 0.77 | LTA4H (0.38) | TSHRCA4LTA4HKCNA3 | |
| SCHEMBL4460772 | 0.75 | PPARA (0.35) | CA4LTA4H |
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-7612148-B2 | Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2009-11-03 | — | — | US | disclosed |
| US-20080146733-A1 | Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2008-06-19 | — | — | US | disclosed |