Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PLG | P00747 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
| ▸ | CTRC | Q99895 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL29099283 | 0.98 | CYP19A1 (0.35) | CYP19A1SIGMAR1MEN1KMT2AALDH1A1 | |
| SCHEMBL28051889 | 0.83 | SLC6A3 (0.41) | SIGMAR1MEN1KMT2ATSHRTP53 | |
| SCHEMBL28139788 | 0.80 | LMNA (0.38) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL29021517 | 0.80 | GSK3B (0.36) | CYP19A1SIGMAR1MEN1KMT2AALDH1A1 | |
| SCHEMBL27507721 | 0.78 | SIGMAR1 (0.38) | CYP19A1SIGMAR1MEN1KMT2AALDH1A1 | |
| SCHEMBL27515932 | 0.76 | ACHE (0.41) | SIGMAR1ALDH1A1LMNAMAPTELANE | |
| SCHEMBL5610169 | 0.76 | SIGMAR1 (0.36) | CYP19A1SIGMAR1MEN1KMT2AALDH1A1 | |
| Bromide SCHEMBL27410484 | 0.75 | SIGMAR1 (0.35) | CYP19A1SIGMAR1MEN1KMT2AALDH1A1 | |
| Bromide SCHEMBL27722888 | 0.75 | ACHE (0.40) | SIGMAR1ALDH1A1LMNAMAPTELANE | |
| Hydrochloric Acid SCHEMBL28350609 | 0.75 | ACHE (0.40) | SIGMAR1ALDH1A1LMNAMAPTELANE |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113717099-A | Bromination reaction method and application of nitrogen-containing heterocyclic compound | 四川大学 | 2021-11-30 | — | — | CN | claimed |
| CN-113717099-B | Method for bromination reaction of nitrogen-containing heterocyclic compound and application | 四川大学 | 2023-06-27 | — | — | CN | disclosed |
| CN-113717099-B | Method for bromination reaction of nitrogen-containing heterocyclic compound and application | 四川大学 | 2023-06-27 | — | — | CN | disclosed |
| CN-113717099-A | Bromination reaction method and application of nitrogen-containing heterocyclic compound | 四川大学 | 2021-11-30 | — | — | CN | disclosed |
| CN-113717099-A | Bromination reaction method and application of nitrogen-containing heterocyclic compound | 四川大学 | 2021-11-30 | — | — | CN | disclosed |
| CN-113527189-A | Pyridine-3-formaldehyde compound and preparation method thereof | 四川大学 | 2021-10-22 | — | — | CN | disclosed |