Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | PGK1 | P00558 | 1/20 | 0.36 |
| ▸ | PGK2 | P07205 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TSPO | P30536 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1097510 | 0.82 | ALDH1A1 (0.40) | TPMTPGK1PGK2KDM4EHTT | |
| SCHEMBL1043692 | 0.79 | ALDH1A1 (0.38) | TPMTPGK1PGK2KDM4EHTT | |
| SCHEMBL27477530 | 0.79 | ALDH1A1 (0.38) | TPMTPGK1PGK2KDM4EPOLB | |
| SCHEMBL4959945 | 0.77 | PGK1 (0.42) | PGK1PGK2KDM4EHTTNPSR1 | |
| Glycolic Acid SCHEMBL9282210 | 0.76 | ALDH1A1 (0.57) | TPMTFFAR1FFAR4KDM4EHTT | |
| SCHEMBL7718881 | 0.73 | SLC7A5 (0.59) | KDM4EPOLBHTTNPSR1SLC7A5 | |
| SCHEMBL593771 | 0.73 | TPMT (0.48) | TPMTFFAR1PGK1PGK2KDM4E | |
| SCHEMBL32665666 | 0.72 | TPMT (0.67) | TPMTKDM4EPOLBKMT2AMEN1 | |
| SCHEMBL1175637 | 0.72 | TPMT (0.67) | TPMTKDM4EPOLBKMT2AMEN1 | |
| SCHEMBL92965 | 0.71 | ACHE (0.48) | TPMTPGK1PGK2KDM4EALDH1A1 |
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-0528495-A1 | Azacyclic compounds, processes for their preparation and pharmaceutical compositions containing them | MERCK SHARP & DOHME LTD. (GB) | 1993-02-24 | — | — | EP | disclosed |