Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 5/20 | 0.43 |
| ▸ | CES1 | P23141 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6301692 | 0.97 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL1783027 | 0.90 | CES1 (0.40) | TSHRTHRBCES2CES1ALDH1A1 | |
| Zinc Ion SCHEMBL29948897 | 0.86 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 | |
| Lithium Ion SCHEMBL2106571 | 0.86 | — | — | |
| SCHEMBL28862786 | 0.86 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL29407263 | 0.86 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL38662306 | 0.86 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL167089 | 0.86 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL7738518 | 0.86 | — | — | |
| SCHEMBL6519543 | 0.86 | TSHR (0.50) | TSHRTHRBCES2CES1ALDH1A1 |
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-6881797-B2 | Process for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2005-04-19 | — | — | US | disclosed |
| US-20040082727-A1 | Process for hydrogenation of conjugated diene polymer | TSRC CORPORATION (CN) | 2004-04-29 | — | — | US | disclosed |