Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | JMJD7 | P0C870 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13636993 | 0.82 | HTR2C (0.43) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL13636799 | 0.78 | MAPT (0.42) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL1945683 | 0.73 | HPGD (0.51) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL1946102 | 0.71 | HPGD (0.41) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL12543240 | 0.70 | DHODH (0.50) | KDM4EMAPTHPGDALDH1A1POLB | |
| SCHEMBL1945680 | 0.69 | RXFP1 (0.55) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL1945681 | 0.68 | RXFP1 (0.57) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL1944624 | 0.68 | NAMPT (0.51) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL12542531 | 0.67 | ASAH1 (0.51) | ACKR3KDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL1946018 | 0.67 | HDAC8 (0.46) | ACKR3KDM4EMAPTHPGDALDH1A1 |
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-2009137081-A2 | SMALL MOLECULE INHIBITORS OF PLASMODIUM FALCIPARUM DIHYDROOROTATE DEHYDROGENASE | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2009-11-12 | — | — | WO | disclosed |