Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TNKS | O95271 | 1/20 | 0.43 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 8/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.40 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20185045 | 0.86 | KDM4E (0.46) | KDM4EHSD17B10TNKSIRAK4 | |
| SCHEMBL18216445 | 0.86 | KDM4E (0.46) | KDM4EHSD17B10TNKSIRAK4 | |
| SCHEMBL18208327 | 0.86 | KDM4E (0.46) | KDM4EHSD17B10TNKSIRAK4 | |
| SCHEMBL20185038 | 0.86 | KDM4E (0.46) | KDM4EHSD17B10TNKSIRAK4 | |
| SCHEMBL18208323 | 0.86 | KDM4E (0.46) | KDM4EHSD17B10TNKSIRAK4 | |
| SCHEMBL20185046 | 0.86 | KDM4E (0.46) | KDM4EHSD17B10TNKSIRAK4 | |
| SCHEMBL20118061 | 0.86 | KDM4E (0.47) | KDM4EHSD17B10PKMTNKSIRAK4 | |
| SCHEMBL20118060 | 0.86 | KDM4E (0.47) | KDM4EHSD17B10PKMTNKSIRAK4 | |
| SCHEMBL20118240 | 0.86 | KDM4E (0.47) | KDM4EHSD17B10PKMTNKSIRAK4 | |
| SCHEMBL18208502 | 0.79 | IRAK4 (0.49) | KDM4EHSD17B10TNKSIRAK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018078009-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |