Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | PHGDH | O43175 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL29428436 | 0.91 | HDAC1 (0.40) | KMT2AHDAC1TACR1KDM4EPOLB | |
| SCHEMBL28838323 | 0.89 | LMNA (0.44) | KMT2AHDAC1KDM4EPOLBALDH1A1 | |
| SCHEMBL28838325 | 0.85 | TACR1 (0.51) | HDAC1TACR1 | |
| SCHEMBL29428448 | 0.84 | ALDH1A1 (0.53) | KMT2ACES2CES1KDM4ENPC1 | |
| SCHEMBL29428440 | 0.84 | TDP1 (0.46) | ALDH1A1 | |
| SCHEMBL8706846 | 0.82 | CES2 (0.53) | KMT2AHDAC1TACR1CES2CES1 | |
| SCHEMBL7497496 | 0.78 | KMT2A (0.46) | KMT2AHDAC1KDM4EPOLBFAAH | |
| SCHEMBL28941358 | 0.77 | HDAC1 (0.50) | KMT2AHDAC1TACR1KDM4EPOLB | |
| SCHEMBL4447294 | 0.76 | KMT2A (0.46) | KMT2AHDAC1TACR1KDM4EALDH1A1 | |
| SCHEMBL23611190 | 0.75 | HDAC1 (0.46) | KMT2AHDAC1TACR1KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-114805044-A | Novel method for synthesizing dibromo compound | 兰州大学 | 2022-07-29 | — | — | CN | disclosed |
| CN-110256274-B | Method for preparing N-methyl-N-phenyl-2, 3-dibromo-3-substituted phenylpropionamide compound | 安徽理工大学 | 2022-02-15 | — | — | CN | disclosed |