Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL20459834 | 0.86 | SMN1; SMN2 (0.33) | SMN1; SMN2LRRK2HPGDALDH1A1TSHR | |
| SCHEMBL20459560 | 0.85 | SMN1; SMN2 (0.35) | SMN1; SMN2HPGDALDH1A1TSHRUSP2 | |
| SCHEMBL20459591 | 0.68 | TACR1 (0.31) | KDM4E | |
| SCHEMBL883641 | 0.63 | PIK3CA (0.47) | SMN1; SMN2LRRK2ALDH1A1 | |
| SCHEMBL23617989 | 0.59 | TSHR (0.56) | SMN1; SMN2HPGDALDH1A1TSHRUSP2 | |
| SCHEMBL17108576 | 0.59 | VNN1 (0.34) | F10 | |
| SCHEMBL926070 | 0.59 | KCNN4 (0.35) | ALDH1A1TSHR | |
| SCHEMBL20459751 | 0.59 | VNN1 (0.37) | SMN1; SMN2 | |
| SCHEMBL24975805 | 0.59 | LMNA (0.47) | SMN1; SMN2HPGDALDH1A1TSHRF10 | |
| SCHEMBL7746677 | 0.58 | ALDH1A1 (0.71) | SMN1; SMN2CNR1HPGDALDH1A1TSHR |
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-2900241-B1 | NOVEL COMPOUNDS THAT ARE ERK INHIBITORS | MERCK SHARP & DOHME (US) | 2018-08-08 | — | — | EP | disclosed |