Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | BCHE | P06276 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | CRHBP | P24387 | 1/20 | 0.51 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | BCL9 | O00512 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9192899 | 0.91 | PTGS2 (0.80) | PTGS2LMNACA1CA2BCHE | |
| SCHEMBL9192906 | 0.91 | PTGS2 (0.80) | PTGS2LMNACA1CA2BCHE | |
| SCHEMBL28049501 | 0.88 | LMNA (0.56) | PTGS2LMNACA1CA2ALDH1A1 | |
| SCHEMBL45896 | 0.86 | PTGS2 (0.80) | PTGS2LMNACA1CA2BCHE | |
| SCHEMBL8746688 | 0.86 | LMNA (0.58) | PTGS2LMNACA1CA2ALDH1A1 | |
| SCHEMBL11271645 | 0.86 | PTGS2 (0.59) | PTGS2LMNACA1CA2BCHE | |
| Hydrochloric Acid SCHEMBL10553766 | 0.84 | LMNA (0.56) | PTGS2LMNACA1CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10553753 | 0.84 | LMNA (0.56) | PTGS2LMNACA1CA2ALDH1A1 | |
| SCHEMBL3132216 | 0.83 | PTGS2 (0.56) | PTGS2LMNACA1CA2BCHE | |
| Methylamine SCHEMBL7163575 | 0.83 | PTGS2 (0.75) | PTGS2LMNACA1CA2BCHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101305000-A | 5-oxo-5,8-dihydro-pyrido-pyrimidines as inhibitors of C-FMS kinase | JANSSEN PHARMACEUTICA NV (BE) | 2008-11-12 | — | — | CN | disclosed |
| CN-1120154-C | 4-hydroxy-piperidine derivatives | HOFFMANN LA ROCHE (CH) | 2003-09-03 | — | — | CN | disclosed |
| CN-1171396-A | 4-hydroxy-piperidine derivatives | HOFFMANN LA ROCHE (CH) | 1998-01-28 | — | — | CN | disclosed |