Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | LPL | P06858 | 2/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL11424007 | 0.86 | KCNH2 (0.43) | RORCESR1ESR2MEN1KMT2A | |
| SCHEMBL12044712 | 0.83 | CYP2A6 (0.50) | RORCESR1ESR2LPLLIPG | |
| SCHEMBL19972655 | 0.82 | CA2 (0.43) | RORCESR1ESR2CA2ALDH1A1 | |
| SCHEMBL3942362 | 0.82 | TAAR1 (0.52) | RORCESR1ESR2ALDH1A1KMT2A | |
| SCHEMBL8763390 | 0.81 | ESR1 (0.44) | RORCESR1ESR2ALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL3943536 | 0.81 | TAAR1 (0.50) | ESR1ESR2ALDH1A1KMT2AKDM4E | |
| SCHEMBL6563317 | 0.80 | KIF11 (0.41) | RORCESR1ESR2ALDH1A1MEN1 | |
| SCHEMBL7192113 | 0.78 | KCNH2 (0.41) | RORCESR1ESR2THRBALDH1A1 | |
| SCHEMBL309341 | 0.78 | LOXL2 (0.48) | RORCESR1ESR2MTOR | |
| SCHEMBL1557927 | 0.78 | ESR1 (0.42) | RORCESR1ESR2ALDH1A1MEN1 |
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-2022010880-A1 | KCNT1 INHIBITORS AND METHODS OF USE | PRAXIS PRECISION MEDICINES, INC. (US) | 2022-01-13 | — | — | WO | disclosed |
| WO-2018053267-A1 | INHIBITORS OF THE MENIN-MLL INTERACTION | VITAE PHARMACEUTICALS, INC. (US) | 2018-03-22 | — | — | WO | disclosed |