Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | FKBP1A | P62942 | 5/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL16399939 | 1.00 | KDM4E (0.40) | KDM4ESMN1; SMN2MAPK10POLBFKBP1A | |
| SCHEMBL2513454 | 0.95 | KDM4E (0.41) | KDM4ESMN1; SMN2POLBNPSR1TSHR | |
| SCHEMBL17069028 | 0.83 | P2RX7 (0.43) | KDM4ESMN1; SMN2MAPK10POLBNPSR1 | |
| SCHEMBL28068792 | 0.81 | KDM4E (0.42) | KDM4ESMN1; SMN2MAPK10POLBFKBP1A | |
| SCHEMBL16399968 | 0.81 | KDM4E (0.42) | KDM4ESMN1; SMN2MAPK10POLBFKBP1A | |
| SCHEMBL2654686 | 0.78 | CA12 (0.41) | KDM4ECA12CA1CA2CA9 | |
| SCHEMBL9595849 | 0.78 | POLB (0.46) | KDM4ESMN1; SMN2POLBFKBP1A | |
| SCHEMBL9595842 | 0.78 | POLB (0.46) | KDM4ESMN1; SMN2POLBFKBP1A | |
| SCHEMBL15208035 | 0.77 | KDM4E (0.42) | KDM4ESMN1; SMN2POLBFKBP1ANPSR1 | |
| SCHEMBL27230129 | 0.77 | KDM4E (0.42) | KDM4ESMN1; SMN2POLBFKBP1ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105555783-A | Autotaxin inhibitors comprising a heteroaromatic ring-benzyl-amide-cycle core | NOVARTIS AG | 2016-05-04 | — | — | CN | disclosed |