Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17230076 | 0.83 | GRIN2B (0.48) | NOS1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL22052983 | 0.83 | ALDH1A1 (0.38) | NOS1THRBIDO1PKMALDH1A1 | |
| SCHEMBL14255673 | 0.80 | NOS1 (0.45) | NOS1THRBIDO1GRIN2DGRIN3B | |
| SCHEMBL18758459 | 0.78 | GRIN2D (0.45) | NOS1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL20901881 | 0.77 | NOS2 (0.36) | NOS1PKMALDH1A1KDM4EHPGD | |
| SCHEMBL6898308 | 0.75 | CYP3A4 (0.67) | NOS1THRBIDO1PKMCYP3A4 | |
| SCHEMBL22273465 | 0.75 | MIF (0.35) | NOS1IDO1MAPTKMT2AMEN1 | |
| SCHEMBL22052502 | 0.75 | MIF (0.35) | NOS1IDO1MAPTKMT2AMEN1 | |
| SCHEMBL11289366 | 0.74 | NOS1 (0.56) | NOS1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL7166919 | 0.74 | CHRM2 (0.58) | NOS1THRBIDO1CYP3A4CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2824713-B1 | A backsheet for photovoltaic modules | AGFA-GEVAERT (BE) | 2017-02-22 | — | — | EP | disclosed |
| US-9120751-B2 | Compounds that modulate intracellular calcium | CALCIMEDICA, INC. (US) | 2015-09-01 | — | — | US | disclosed |