Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MMP1 | P03956 | 1/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | MMP12 | P39900 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27689604 | 0.82 | ALDH1A1 (0.51) | ALDH1A1LMNAKDM4EMMP1MMP2 | |
| SCHEMBL20724273 | 0.81 | ALDH1A1 (0.57) | ALDH1A1LMNAKDM4EMMP1MMP2 | |
| SCHEMBL27312517 | 0.81 | ALDH1A1 (0.52) | ALDH1A1LMNAKDM4EMAOBRAB9A | |
| SCHEMBL3231685 | 0.80 | ALDH1A1 (0.59) | ALDH1A1LMNAKDM4EMMP1MMP2 | |
| SCHEMBL4677113 | 0.80 | SMN1; SMN2 (0.54) | ALDH1A1LMNAKDM4EMMP1MMP2 | |
| SCHEMBL1790733 | 0.80 | ALDH1A1 (0.58) | ALDH1A1LMNAKDM4EMMP1MMP2 | |
| SCHEMBL28702044 | 0.80 | ALDH1A1 (0.58) | ALDH1A1LMNAKDM4EMMP1MMP2 | |
| SCHEMBL24991646 | 0.79 | IDO1 (0.47) | ALDH1A1LMNAKDM4EIDO1RAB9A | |
| SCHEMBL11036359 | 0.79 | ALDH1A1 (0.41) | ALDH1A1LMNAKDM4ERAB9AKMT2A | |
| SCHEMBL20494542 | 0.79 | TOP2A (0.42) | ALDH1A1LMNAKDM4ERAB9AKMT2A |
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-2004054579-A1 | 2-PYRIDYL AND 2-PYRIMIDYL CYCLOALKYLENE AMIDE COMPOUNDS AS NR2B RECEPTOR ANTAGONISTS | PFIZER JAPAN INC. (JP) | 2004-07-01 | — | — | WO | disclosed |