Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.33 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.33 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19210181 | 0.88 | THRB (0.51) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL29124873 | 0.86 | ALDH1A1 (0.54) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL28827207 | 0.86 | CYP3A4 (0.38) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL29402176 | 0.86 | TSHR (0.49) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL30408129 | 0.85 | ALDH1A1 (0.51) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL29399722 | 0.85 | TSHR (0.51) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL29399111 | 0.85 | TSHR (0.51) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL29399736 | 0.85 | TSHR (0.51) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL29124872 | 0.82 | CYP3A4 (0.59) | CYP3A4THRBALDH1A1TSHRHSD17B10 | |
| SCHEMBL28431291 | 0.80 | CYP3A4 (0.67) | CYP3A4ALDH1A1TSHRHSD17B10CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5122061-A | Two part composition of acrylate or methacrylate monomers, trialkylboron or oxide thereof; for dental composite resin | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-06-16 | — | — | US | disclosed |