Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ADH1B | P00325 | 1/20 | 0.39 |
| ▸ | ADH1C | P00326 | 1/20 | 0.39 |
| ▸ | ADH1A | P07327 | 1/20 | 0.39 |
| ▸ | ADH4 | P08319 | 1/20 | 0.39 |
| ▸ | ADH7 | P40394 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.32 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19261996 | 0.93 | SIGMAR1 (0.36) | SIGMAR1ACHEADH1BADH1CADH1A | |
| SCHEMBL22047967 | 0.93 | SIGMAR1 (0.45) | SIGMAR1ACHEADH1BADH1CADH1A | |
| SCHEMBL22704489 | 0.93 | SIGMAR1 (0.43) | SIGMAR1ACHEADH1BADH1CADH1A | |
| SCHEMBL22704480 | 0.91 | SIGMAR1 (0.42) | SIGMAR1ACHEADH1BADH1CADH1A | |
| SCHEMBL24645750 | 0.91 | SIGMAR1 (0.42) | SIGMAR1ACHEADH1BADH1CADH1A | |
| SCHEMBL12018277 | 0.89 | SIGMAR1 (0.39) | SIGMAR1ACHEADH1BADH1CADH1A | |
| SCHEMBL13638469 | 0.89 | CARM1 (0.38) | SIGMAR1CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL8275755 | 0.89 | CARM1 (0.38) | SIGMAR1CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL16727917 | 0.89 | CARM1 (0.38) | SIGMAR1CARM1PRMT6PRMT1PRMT8 | |
| SCHEMBL21106601 | 0.86 | SIGMAR1 (0.54) | SIGMAR1ADH1BADH1CADH1AADH4 |
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-2019113542-A1 | HETEROCYCLE SUBSTITUTED PYRIDINE DERIVATIVE ANTIFUNGAL AGENTS | AMPLYX PHARMACEUTICALS, INC. (US) | 2019-06-13 | — | — | WO | disclosed |