Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 7/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20740677 | 0.87 | DHFR (0.69) | DHFRSLC2A1TP53TSHR | |
| SCHEMBL20740676 | 0.86 | DHFR (0.48) | DHFRSLC2A1TP53MAPK1TSHR | |
| SCHEMBL2469151 | 0.79 | MAPT (0.89) | MAPTRAB9ATDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL20740672 | 0.78 | DHFR (0.56) | DHFRMAPTSLC2A1SMN1; SMN2KMT2A | |
| SCHEMBL20740670 | 0.78 | DHFR (0.53) | DHFRRAB9ASLC2A1SMN1; SMN2NPC1 | |
| SCHEMBL11171761 | 0.77 | DHFR (0.57) | DHFRMAPTSLC2A1KMT2AALDH1A1 | |
| SCHEMBL11171619 | 0.77 | DHFR (0.57) | DHFRMAPTSLC2A1KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL11185095 | 0.76 | DHFR (0.56) | DHFRMAPTSLC2A1KMT2AALDH1A1 | |
| SCHEMBL20740675 | 0.76 | KMT2A (0.54) | DHFRSLC2A1KMT2A | |
| SCHEMBL1796892 | 0.75 | MAPT (0.79) | MAPTRAB9ATDP1L3MBTL1SMN1; SMN2 |
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-2194985-B1 | ANTIMALARIAL COMPOUNDS WITH FLEXIBLE SIDE-CHAINS | MEDICINES FOR MALARIA VENTURE MMV (CH) | 2019-02-20 | — | — | EP | claimed |
| EP-2194985-B1 | ANTIMALARIAL COMPOUNDS WITH FLEXIBLE SIDE-CHAINS | MEDICINES FOR MALARIA VENTURE MMV (CH) | 2019-02-20 | — | — | EP | disclosed |