Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL21159436 | 0.85 | HTT (0.37) | ESR1ESR2SLC2A1CSF1RTP53 | |
| SCHEMBL5248227 | 0.73 | EGFR (0.38) | CSF1RTP53LMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL10873653 | 0.69 | KDM4C (0.60) | RAB9AGALR3TP53KDM4CLMNA | |
| SCHEMBL21544332 | 0.69 | ALDH1A1 (0.52) | RAB9AGALR3CSF1RTP53LMNA | |
| SCHEMBL21159607 | 0.67 | ALDH1A1 (0.47) | RAB9AGALR3AOC3LMNAALDH1A1 | |
| SCHEMBL21159461 | 0.67 | HTT (0.37) | RAB9AGALR3KDM4CLMNASMN1; SMN2 | |
| SCHEMBL17802579 | 0.67 | RAB9A (0.75) | RAB9AGALR3KDM4CLMNASMN1; SMN2 | |
| SCHEMBL934572 | 0.66 | BCL2A1 (0.51) | RAB9AESR1ESR2PTPN1AOC3 | |
| SCHEMBL933733 | 0.66 | ESR1 (0.57) | ESR1ESR2AOC3ALDH1A1LOXL2 | |
| Hydrochloric Acid SCHEMBL9457770 | 0.65 | BCL2A1 (0.50) | RAB9AESR1ESR2PTPN1AOC3 |
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-3505171-A1 | BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND | Mitsubishi Tanabe Pharma Corporation (JP) | 2019-07-03 | — | — | EP | disclosed |