Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.47 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.47 |
| ▸ | LTK | P29376 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.47 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30689174 | 0.82 | NOS1 (0.55) | NOS1HSD17B10TDP1MEN1KMT2A | |
| SCHEMBL29521160 | 0.82 | NOS1 (0.50) | NOS1HSD17B10TDP1MEN1KMT2A | |
| SCHEMBL10708771 | 0.82 | PLK4 (0.51) | NOS1HSD17B10TDP1MEN1KMT2A | |
| SCHEMBL792737 | 0.82 | NOS1 (0.55) | NOS1HSD17B10TDP1MEN1KMT2A | |
| SCHEMBL29780179 | 0.78 | NOS1 (0.46) | NOS1HSD17B10TDP1MEN1KMT2A | |
| SCHEMBL24629897 | 0.74 | NOS1 (0.41) | NOS1TDP1MEN1KMT2AL3MBTL1 | |
| SCHEMBL24629859 | 0.72 | NOS1 (0.40) | NOS1MEN1KMT2AIDO1 | |
| SCHEMBL24629442 | 0.72 | MAPT (0.34) | NOS1MEN1KMT2AMAPTPTK2 | |
| SCHEMBL1077138 | 0.71 | NOS1 (0.55) | NOS1CYP1A2CYP3A4HPGDCYP2C19 | |
| SCHEMBL104360 | 0.71 | NOS1 (1.00) | NOS1HSD17B10TDP1MEN1KMT2A |
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-2023250157-A9 | INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE | CORNELL UNIVERSITY (US) | 2024-01-25 | — | — | WO | disclosed |
| WO-2023250157-A1 | INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE | CORNELL UNIVERSITY (US) | 2023-12-28 | — | — | WO | disclosed |