Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7569777 | 0.88 | CYP2C9 (0.64) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL25072992 | 0.87 | CYP2C9 (0.64) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL1138924 | 0.87 | CYP2C9 (0.63) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL25072986 | 0.86 | KDM4E (0.63) | ALDH1A1KDM4EPOLBKMT2AMEN1 | |
| SCHEMBL6978287 | 0.86 | CYP2C9 (0.64) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL25073092 | 0.84 | ALDH1A1 (0.56) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL30278430 | 0.84 | ALDH1A1 (0.56) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL25072525 | 0.81 | MAPT (0.53) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL23380710 | 0.81 | CYP2C9 (0.61) | ALDH1A1CYP2C9KDM4ETSHRNPSR1 | |
| SCHEMBL25072957 | 0.80 | KDM4E (0.56) | ALDH1A1KDM4EKMT2AMEN1LMNA |
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 |