Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | STS | P08842 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4071489 | 0.81 | KMT2A (0.52) | KMT2AALDH1A1CA1CA2CA9 | |
| SCHEMBL27952719 | 0.80 | TDP1 (0.52) | KMT2AALDH1A1STSPPARGLMNA | |
| SCHEMBL15800925 | 0.80 | KMT2A (0.50) | KMT2AALDH1A1CA1CA2CA9 | |
| SCHEMBL15801009 | 0.79 | KMT2A (0.49) | KMT2ACA1CA2CA9MEN1 | |
| SCHEMBL28022548 | 0.77 | THRB (0.57) | KMT2AALDH1A1CA1CA2CA9 | |
| SCHEMBL15800975 | 0.77 | KMT2A (0.47) | KMT2AALDH1A1CA1CA2CA9 | |
| SCHEMBL15800970 | 0.75 | KMT2A (0.45) | KMT2ACA1CA2CA9MEN1 | |
| SCHEMBL27582686 | 0.75 | KMT2A (0.57) | KMT2ACA1CA2CA9MEN1 | |
| SCHEMBL6252538 | 0.74 | KMT2A (0.61) | KMT2AALDH1A1CA1CA2CA9 | |
| SCHEMBL27885346 | 0.74 | KMT2A (0.61) | KMT2AALDH1A1CA1CA2CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1131854-C | 1-(1,2-disubstituted piperidinyl)-4-substituted piperidine derivatives as tachykinin receptor antagonists | JANSSEN PHARMACEUTICA NV (BE) | 2003-12-24 | — | — | CN | disclosed |
| CN-1206406-A | 1-(1,2-disubstituted piperidinyl)-4-substituted piperidine derivatives as tachykinin receptor antagonists | JANSSEN PHARMACEUTICA NV (BE) | 1999-01-27 | — | — | CN | disclosed |