Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 3/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA7 | P43166 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21596479 | 0.84 | CA12 (0.41) | MAPTKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL28528395 | 0.84 | GABRG2 (0.41) | OPRK1P2RX3ALDH1A1GABRG2GABRB3 | |
| SCHEMBL28535766 | 0.84 | OPRK1 (0.48) | OPRK1MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL28526753 | 0.84 | ATR (0.38) | OPRK1AAK1ALDH1A1GABRG2GABRB3 | |
| SCHEMBL4920924 | 0.71 | KDR (0.45) | OPRK1MAPTKDM4EALDH1A1GABRG2 | |
| SCHEMBL21596476 | 0.70 | OPRK1 (0.40) | OPRK1KDM4EALDH1A1MEN1MAPK1 | |
| SCHEMBL18044633 | 0.70 | AAK1 (0.38) | OPRK1AAK1ALDH1A1GABRG2GABRB3 | |
| SCHEMBL1505507 | 0.69 | OPRK1 (0.46) | OPRK1KDM4EALDH1A1ATR | |
| SCHEMBL733159 | 0.69 | OPRK1 (0.49) | OPRK1 | |
| SCHEMBL29149064 | 0.69 | CA12 (0.41) | MAPTKDM4EALDH1A1GABRG2GABRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3810585-A1 | PROCESS FOR PREPARING TRICYCLIC COMPOUNDS | Bayer Aktiengesellschaft (DE) | 2021-04-28 | — | — | EP | disclosed |
| WO-2019243243-A1 | PROCESS FOR PREPARING TRICYCLIC COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 2019-12-26 | — | — | WO | disclosed |