Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 6/20 | 0.70 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.54 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6969615 | 0.86 | XDH (0.66) | XDHKDM4EMEN1ALDH1A1MAPK1 | |
| SCHEMBL14801814 | 0.71 | MCL1 (0.71) | XDHMCL1GSTP1MEN1MAPK1 | |
| SCHEMBL6974659 | 0.70 | XDH (0.46) | XDHMEN1ALDH1A1MAPK1KMT2A | |
| SCHEMBL28133262 | 0.70 | GSK3B (0.65) | XDHKDM4EMEN1ALDH1A1MAPK1 | |
| SCHEMBL11146636 | 0.69 | CYP1A2 (0.71) | XDHGPR84GSTP1MEN1KMT2A | |
| SCHEMBL13203160 | 0.69 | MCL1 (0.69) | XDHMCL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL21882451 | 0.69 | MCL1 (0.69) | XDHMCL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL21882397 | 0.69 | MCL1 (0.69) | XDHMCL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL20220304 | 0.69 | MAPK1 (0.68) | XDHMCL1KDM4EMEN1ALDH1A1 | |
| SCHEMBL20220275 | 0.69 | MAPK1 (0.68) | XDHMCL1KDM4EMEN1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1109560-B1 | COMPOUNDS USEFUL AS AICARFT INHIBITORS | AGOURON PHARMA (US) | 2003-08-27 | — | — | EP | disclosed |
| US-6525050-B1 | Inhibit the enzyme aminoimidazole carboxamide ribonucleotide formyl transferase; antiproliferative agents; antitumor, antiinflammatory, antipsoriatic, and/or immunosuppressive | AGOURON PHARMACEUTICALS, INC. | 2003-02-25 | — | — | US | disclosed |
| EP-1109560-A4 | COMPOUNDS USEFUL AS AICARFT INHIBITORS | AGOURON PHARMA (US) | 2002-04-17 | — | — | EP | disclosed |
| EP-1109560-A1 | COMPOUNDS USEFUL AS AICARFT INHIBITORS | AGOURON PHARMACEUTICALS, INC. (US) | 2001-06-27 | — | — | EP | disclosed |
| WO-2000013688-A1 | COMPOUNDS USEFUL AS AICARFT INHIBITORS | AGOURON PHARMACEUTICALS, INC. (US) | 2000-03-16 | — | — | WO | disclosed |