Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8371130 | 0.96 | VCAM1 (0.39) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL11328343 | 0.84 | MAPT (0.51) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL11524765 | 0.82 | MAPT (0.59) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL11320225 | 0.80 | TDP1 (0.43) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL8660358 | 0.80 | CYP1A2 (0.37) | MAPTCYP3A4CYP1A2TDP1TSHR | |
| SCHEMBL11317064 | 0.78 | TDP1 (0.55) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL7529889 | 0.78 | CYP3A4 (0.40) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL10792911 | 0.76 | CYP1A2 (0.44) | MAPTCYP3A4CYP1A2TDP1TSHR | |
| SCHEMBL8331984 | 0.76 | CYP3A4 (0.49) | MAPTCYP3A4MAPK1VCAM1CYP1A2 | |
| SCHEMBL31413507 | 0.75 | CYP1A2 (0.38) | MAPTCYP3A4MAPK1CYP1A2TDP1 |
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-4136117-A | PREPARATION OF 2,6-DINITROANILINES | AMERICAN CYANAMID COMPANY (US) | 1979-01-23 | — | — | US | disclosed |