Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ADA | P00813 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8799931 | 0.87 | TSHR (0.36) | TSHRNPSR1MAPTCPB2ALDH1A1 | |
| SCHEMBL8798766 | 0.84 | CYP3A4 (0.37) | MAPK1SMN1; SMN2GRM2TSHRADA | |
| SCHEMBL8798264 | 0.82 | TBXAS1 (0.37) | MAPK1SMN1; SMN2TBXAS1ALDH1A1CYP3A4 | |
| SCHEMBL8798844 | 0.77 | DPP4 (0.40) | MAPK1SMN1; SMN2GRM2TSHRADA | |
| SCHEMBL8799774 | 0.77 | CYP17A1 (0.35) | TSHRMAPTALDH1A1PKMKMT2A | |
| SCHEMBL8799646 | 0.76 | MAPK1 (0.37) | MAPK1SMN1; SMN2CCNCCDK8GRM2 | |
| SCHEMBL8800048 | 0.76 | PGR (0.35) | MAPK1SMN1; SMN2TSHRMAPTRAB9A | |
| SCHEMBL8633548 | 0.75 | SLC7A5 (0.40) | SMN1; SMN2TSHRNPSR1RAB9ANPC1 | |
| SCHEMBL8329548 | 0.74 | LTA4H (0.41) | TSHRMAPTALDH1A1KMT2A | |
| SCHEMBL1969926 | 0.73 | PPARA (0.56) | MAPK1SMN1; SMN2CCNCCDK8GRM2 |
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-0792878-A2 | Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism | Dompé S.P.A. (IT) | 1997-09-03 | — | — | EP | disclosed |