Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 2/20 | 0.51 |
| ▸ | GSK3B | P49841 | 2/20 | 0.51 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.44 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.44 |
| ▸ | TNKS | O95271 | 2/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | WNT3 | P56703 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20138814 | 1.00 | GSK3A (0.51) | GSK3AGSK3BKDRMEN1KMT2A | |
| SCHEMBL20138800 | 0.89 | GSK3B (0.51) | GSK3AGSK3BMEN1KMT2AP2RX7 | |
| SCHEMBL20138801 | 0.89 | GSK3B (0.51) | GSK3AGSK3BMEN1KMT2AP2RX7 | |
| SCHEMBL20142976 | 0.84 | HPGD (0.50) | KDRMEN1KMT2ACASP3SENP8 | |
| SCHEMBL20142977 | 0.84 | HPGD (0.50) | KDRMEN1KMT2ACASP3SENP8 | |
| SCHEMBL20138846 | 0.82 | GSK3A (0.56) | GSK3AGSK3BKMT2AADORA2BALDH1A1 | |
| SCHEMBL20138847 | 0.82 | GSK3A (0.56) | GSK3AGSK3BKMT2AADORA2BALDH1A1 | |
| SCHEMBL18208167 | 0.78 | GSK3B (0.58) | GSK3AGSK3BKMT2AADORA2BABL1 | |
| SCHEMBL18208170 | 0.78 | GSK3B (0.58) | GSK3AGSK3BKMT2AADORA2BABL1 | |
| SCHEMBL20138817 | 0.78 | KCNH2 (0.51) | GSK3AGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018087126-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES AS INHIBITORS OF TANKYRASE | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-17 | — | — | WO | claimed |
| WO-2018087126-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES AS INHIBITORS OF TANKYRASE | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-17 | — | — | WO | disclosed |