Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 9/20 | 0.55 |
| ▸ | PARP15 | Q460N3 | 3/20 | 0.55 |
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.55 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8808591 | 0.86 | MAOB (0.55) | MAOBPARP15PARP10PARP14RAB9A | |
| SCHEMBL21084323 | 0.83 | MAOB (0.49) | MAOBPARP15PARP10PARP14RAB9A | |
| SCHEMBL20085194 | 0.82 | MAOB (0.51) | MAOBPARP15PARP10PARP14RAB9A | |
| SCHEMBL13794698 | 0.81 | TDP1 (0.51) | MAOBRAB9AKMT2ANPC1ESR1 | |
| SCHEMBL10397561 | 0.81 | MAOB (0.60) | MAOBPARP15PARP10PARP14HPD | |
| SCHEMBL13320309 | 0.81 | MAOB (0.65) | MAOBPARP15PARP10PARP14RAB9A | |
| SCHEMBL38655920 | 0.81 | MAOB (0.65) | MAOBPARP15PARP10PARP14RAB9A | |
| SCHEMBL12443168 | 0.81 | PTPN1 (0.53) | MAOBPARP15PARP10PARP14RAB9A | |
| SCHEMBL8623315 | 0.80 | POLB (0.47) | MAOBRAB9AKMT2ANPC1SMN1; SMN2 | |
| SCHEMBL21084234 | 0.80 | LMNA (0.57) | MAOBPARP15PARP10PARP14RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3492461-A1 | NITROGENOUS HETEROCYCLIC AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION THEREOF | Shanghai Yingli Pharmaceutical Co. Ltd. (CN) | 2019-06-05 | — | — | EP | disclosed |