Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 8/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8932025 | 0.97 | ACHE (0.43) | ACHENFE2L2IDO1NOTUMMCL1 | |
| Boric Acid SCHEMBL29277889 | 0.88 | ACHE (0.37) | ACHENFE2L2IDO1GAACES2 | |
| Phosphoric Acid SCHEMBL29277885 | 0.84 | GAA (0.38) | ACHENFE2L2NPC1GAARAB9A | |
| SCHEMBL1880902 | 0.83 | IDO1 (0.41) | ACHEIDO1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29726936 | 0.83 | IDO1 (0.41) | ACHEIDO1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15091550 | 0.79 | ACHE (0.42) | ACHENFE2L2NOTUMNPC1GAA | |
| SCHEMBL18692020 | 0.77 | ACHE (0.46) | ACHENFE2L2NOTUMNPC1GAA | |
| SCHEMBL28071870 | 0.77 | ACHE (0.40) | ACHENFE2L2NOTUMNPC1GAA | |
| SCHEMBL713563 | 0.77 | CES2 (0.38) | ACHEIDO1CES2CES1 | |
| SCHEMBL13621359 | 0.75 | ACHE (0.39) | ACHENFE2L2IDO1NOTUMNPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108084013-B | Synthetic method of 3-bromo-2-fluorobenzoic acid | 蓬莱市前卫化工有限公司 | 2020-09-01 | — | — | CN | claimed |
| CN-108084013-A | A kind of synthetic method of the bromo- 2- fluobenzoic acids of 3- | 上海晋鲁医药科技有限公司 | 2018-05-29 | — | — | CN | claimed |
| CN-108084013-B | Synthetic method of 3-bromo-2-fluorobenzoic acid | 蓬莱市前卫化工有限公司 | 2020-09-01 | — | — | CN | disclosed |
| CN-108084013-B | Synthetic method of 3-bromo-2-fluorobenzoic acid | 蓬莱市前卫化工有限公司 | 2020-09-01 | — | — | CN | disclosed |
| CN-108084013-A | A kind of synthetic method of the bromo- 2- fluobenzoic acids of 3- | 上海晋鲁医药科技有限公司 | 2018-05-29 | — | — | CN | disclosed |