Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | LPAR3 | Q9UBY5 | 5/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.33 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | ADH7 | P40394 | 1/20 | 0.31 |
| ▸ | S1PR2 | O95136 | 4/20 | 0.30 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL4612062 | 0.85 | CTSA (0.32) | MEN1KMT2ACYP3A4 | |
| SCHEMBL4450985 | 0.85 | CYP3A4 (0.58) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL28089281 | 0.83 | LPAR3 (0.54) | CYP3A4LPAR3LPAR1LPAR2TSHR | |
| SCHEMBL9081845 | 0.79 | MEN1 (0.39) | MEN1KMT2ACYP3A4LPAR3LPAR1 | |
| SCHEMBL1396448 | 0.78 | TSHR (0.50) | TSHRTP53TDP1CA12CA1 | |
| SCHEMBL779610 | 0.77 | MEN1 (0.38) | MEN1KMT2ACYP3A4LPAR3LPAR1 | |
| SCHEMBL5357461 | 0.76 | TSHR (0.48) | TSHRTP53TDP1CA12CA1 | |
| SCHEMBL4813823 | 0.75 | MEN1 (0.36) | MEN1KMT2ACYP3A4LPAR3LPAR1 | |
| SCHEMBL4813841 | 0.75 | MEN1 (0.36) | MEN1KMT2ACYP3A4LPAR3LPAR1 | |
| Benzene SCHEMBL25317681 | 0.72 | NPSR1 (0.47) | MEN1KMT2ATSHRALDH1A1TP53 |
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 |