Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.49 |
| ▸ | AXL | P30530 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 3/20 | 0.46 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | GLS | O94925 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1605356 | 0.83 | NOS1 (0.49) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL24654699 | 0.83 | NOS1 (0.49) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL28311637 | 0.80 | NOS1 (0.58) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL2633084 | 0.80 | IDO1 (0.55) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL12272128 | 0.77 | NOS1 (0.53) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL6377270 | 0.77 | NOS1 (0.58) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL14840686 | 0.77 | NOS1 (0.58) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL20458844 | 0.77 | NOS1 (0.53) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL30614204 | 0.77 | NOS1 (0.53) | NOS1AXLIDO1METAP2TDO2 | |
| SCHEMBL29455343 | 0.77 | NOS1 (0.58) | NOS1AXLIDO1METAP2TDO2 |
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-2018039442-A1 | TREATMENT OF CANCER WITH INHIBITORS OF GLUTAMINASE | CALITHERA BIOSCIENCES, INC. (US) | 2018-03-01 | — | — | WO | disclosed |