Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | VCAM1 | P19320 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.39 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GRM6 | O15303 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3244132 | 0.82 | ALDH1A1 (0.41) | ALDH1A1HPGDMAPTGRIA1GRIA2 | |
| SCHEMBL12466385 | 0.76 | MAPT (0.39) | ALDH1A1HPGDVCAM1MAPTGRIA1 | |
| SCHEMBL2890666 | 0.73 | ALDH1A1 (0.47) | ALDH1A1HPGDMAPTGRIA1GRIA2 | |
| SCHEMBL9015211 | 0.70 | ALDH1A1 (0.44) | ALDH1A1HPGDMAPTGRIA1GRIA2 | |
| SCHEMBL5410484 | 0.69 | ALDH1A1 (0.44) | ALDH1A1VCAM1MAPTALOX15TDP1 | |
| SCHEMBL9451720 | 0.69 | KDM4E (0.41) | ALDH1A1HPGDVCAM1MAPTGRIA1 | |
| SCHEMBL27318762 | 0.69 | VCAM1 (0.38) | ALDH1A1HPGDVCAM1MAPTGRIA1 | |
| SCHEMBL27174932 | 0.68 | VCAM1 (0.45) | ALDH1A1HPGDVCAM1MAPTGRIA1 | |
| SCHEMBL31431566 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HPGDVCAM1MAPTGRIA1 | |
| SCHEMBL12778730 | 0.68 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2237971-A | — | — | None | — | — | JP | disclosed |
| CN-1043503-C | Pyrrole carbonitrile and nitro-pyrrole insecticidal, acaricidal and molluscicidal agents and methods for the preparation thereof | AMERICAN CYANAMID CO (US) | 1999-06-02 | — | — | CN | disclosed |
| CN-1029313-C | Preparation method of pyrrole carbonitrile and nitropyrrole | AMERICAN CYANAMID CO (US) | 1995-07-12 | — | — | CN | disclosed |
| CN-1098590-A | The application of pyrrole carbonitrile and nitro-pyrrole | AMERICAN CYANAMID CO (US) | 1995-02-15 | — | — | CN | disclosed |
| JP-H02237971-A | CONTROL OF HARMFUL LIFE | AMERICAN CYANAMID CO | 1990-09-20 | — | — | JP | disclosed |
| CN-1043317-A | Pyrrolonitrile and nitropyrrole insecticides, acaricides and molluscicides and processes for their preparation | AMERICAN CYANAMID CO (US) | 1990-06-27 | — | — | CN | disclosed |