Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 8/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17748882 | 0.86 | KDM1A (0.40) | KDM1AHDAC9OPRM1OPRD1BACE1 | |
| SCHEMBL17748895 | 0.76 | BACE1 (0.33) | KDM1AOPRM1OPRD1BACE1APP | |
| SCHEMBL11884024 | 0.64 | HDAC9 (0.46) | KDM1AHDAC9BACE1MEN1KMT2A | |
| SCHEMBL8708541 | 0.64 | SIGMAR1 (0.41) | KDM1AHDAC9MEN1KMT2ASIGMAR1 | |
| SCHEMBL27660718 | 0.64 | HDAC9 (0.50) | HDAC9BACE1KMT2A | |
| SCHEMBL12077824 | 0.63 | KDM1A (0.55) | KDM1ABACE1TDP1L3MBTL1APP | |
| SCHEMBL20449248 | 0.63 | BACE1 (0.48) | KDM1ABACE1TDP1L3MBTL1APP | |
| SCHEMBL5709421 | 0.63 | KDM1A (0.43) | KDM1AMAOAMAOBSIGMAR1 | |
| SCHEMBL9392173 | 0.63 | AKR1B1 (0.51) | KDM1ABACE1 | |
| SCHEMBL5709333 | 0.63 | KDM1A (0.43) | KDM1AMAOAMAOBSIGMAR1 |
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-107108614-B | Substituted pyrrolopyridines as bromodomain inhibitors | 基因泰克公司 | 2021-06-01 | — | — | CN | disclosed |