Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PGR | P06401 | 2/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7330799 | 0.79 | MAPT (0.68) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL7409497 | 0.79 | MAPT (0.68) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL7409852 | 0.79 | MAPT (0.68) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL10943776 | 0.79 | MAPT (0.68) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL7358296 | 0.72 | MAPT (0.50) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL5158684 | 0.70 | DUSP3 (0.42) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL7366956 | 0.70 | IDO1 (0.62) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL11150740 | 0.69 | MAPT (0.58) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL33978 | 0.68 | DUSP3 (0.52) | MAPTTDP1LMNAPGRTBXA2R | |
| SCHEMBL22157909 | 0.68 | MAPT (0.69) | MAPTTDP1LMNAPGRTBXA2R |
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 |
|---|---|---|---|---|---|---|---|
| US-20230035690-A1 | MACHINE LEARNING TOOLS AND A PROCESS TO DISCOVER NEW NATURAL PRODUCTS BY LINKING GENOMES AND METABOLOMES IN FUNGI | NORTHWESTERN UNIVERSITY | 2023-02-02 | — | — | US | disclosed |