Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9711192 | 0.83 | LTA4H (0.61) | LMNAALDH1A1LTA4HSRD5A2GAA | |
| SCHEMBL27968872 | 0.79 | LMNA (0.69) | CYP19A1LMNAALDH1A1HTTTDP1 | |
| SCHEMBL16114401 | 0.79 | LMNA (0.75) | CYP19A1LMNAALDH1A1HTTTDP1 | |
| SCHEMBL10663084 | 0.78 | CYP19A1 (0.50) | CYP19A1LMNAMAPTALDH1A1HTT | |
| SCHEMBL78141 | 0.77 | LMNA (0.72) | CYP19A1LMNAMAPTALDH1A1HTT | |
| SCHEMBL29500180 | 0.77 | LMNA (0.72) | CYP19A1LMNAMAPTALDH1A1HTT | |
| SCHEMBL103621 | 0.77 | LMNA (0.61) | CYP19A1LMNAALDH1A1HTTTDP1 | |
| SCHEMBL13368188 | 0.77 | TDP1 (0.56) | CYP19A1LMNAALDH1A1TDP1CYP11B1 | |
| SCHEMBL8603770 | 0.76 | NAPRT (0.66) | CYP19A1MAPTALDH1A1HTTGAA | |
| SCHEMBL11071904 | 0.76 | TBXAS1 (0.58) | ALDH1A1CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0100158-A2 | (3-pyridinyl)heteroalkarylalkanols, alkanoic acids and esters | THE UPJOHN COMPANY (US) | 1984-02-08 | — | — | EP | disclosed |