Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28273384 | 0.80 | ALDH1A1 (0.50) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL11683811 | 0.79 | GPR35 (0.57) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL12190333 | 0.76 | CA1 (0.49) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL6518952 | 0.76 | GPR35 (0.53) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL6535736 | 0.76 | GPR35 (0.59) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL12098068 | 0.75 | ALDH1A1 (0.46) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL27560354 | 0.74 | GPR35 (0.57) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL15619260 | 0.74 | ALDH1A1 (0.44) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL422151 | 0.72 | CA1 (0.63) | TSHRCYP3A4ALDH1A1L3MBTL1MAPT | |
| SCHEMBL11802737 | 0.72 | GPR35 (0.64) | GPR35TSHRCYP3A4ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109305983-B | Synthesis method of cyclopropylboronic acid | 沧州普瑞东方科技有限公司 | 2021-01-05 | — | — | CN | disclosed |