Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | HBB | P68871 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24668540 | 0.85 | NFE2L2 (0.50) | KDM4EMEN1KMT2AHPGDTRPA1 | |
| SCHEMBL6666347 | 0.85 | NFE2L2 (0.50) | KDM4EMEN1KMT2AHPGDTRPA1 | |
| SCHEMBL9928814 | 0.84 | MAPT (0.53) | MAPTKDM4EHSD17B10LMNANPC1 | |
| SCHEMBL2963149 | 0.82 | KDM4E (0.50) | MAPTKDM4ENPC1GFERRAB9A | |
| SCHEMBL2963146 | 0.82 | KDM4E (0.50) | MAPTKDM4ENPC1GFERRAB9A | |
| SCHEMBL10383610 | 0.80 | KDM4E (0.40) | KDM4ELMNAMEN1KMT2ATRPA1 | |
| SCHEMBL19052381 | 0.79 | MAPT (0.43) | MAPTKDM4EHSD17B10LMNANPC1 | |
| SCHEMBL24668282 | 0.76 | MAPT (0.50) | MAPTKDM4EHSD17B10LMNANPC1 | |
| SCHEMBL30268526 | 0.76 | MAPT (0.50) | MAPTKDM4EHSD17B10LMNANPC1 | |
| Pyridine SCHEMBL11609450 | 0.72 | RAB9A (0.40) | MAPTKDM4ELMNANPC1RAB9A |
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-2022238694-A1 | VINYL ISOCYANIDE COMPOUNDS AS ANTIBACTERIAL AGENTS | THE UNIVERSITY OF BATH (GB) | 2022-11-17 | — | — | WO | disclosed |