Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | SLC6A15 | Q9H2J7 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL21290415 | 0.84 | PDK2 (0.42) | PTGS1PTGS2DHODHKMT2AHTT | |
| SCHEMBL21290342 | 0.66 | SMN1; SMN2 (0.46) | PTGS1PTGS2DHODHKMT2AMEN1 | |
| SCHEMBL24858035 | 0.66 | KMT2A (0.41) | KMT2AMEN1AGTR1HTTLMNA | |
| SCHEMBL30164381 | 0.66 | KMT2A (0.41) | KMT2AMEN1AGTR1HTTLMNA | |
| SCHEMBL28847068 | 0.64 | ERCC5 (0.56) | HTTLMNARAB9A | |
| SCHEMBL31150536 | 0.64 | GPR27 (0.37) | KMT2AMEN1HTTLMNAPOLB | |
| SCHEMBL30171520 | 0.63 | PTGS1 (0.51) | PTGS1PTGS2POLB | |
| SCHEMBL28405722 | 0.63 | PTGS1 (0.51) | PTGS1PTGS2POLB | |
| SCHEMBL21462378 | 0.63 | OPRK1 (0.46) | PDK2 | |
| SCHEMBL24566123 | 0.63 | DGAT2 (0.38) | KMT2ARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019158453-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2019-08-22 | — | — | WO | disclosed |