Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4351615 | 0.86 | GRIN1 (0.38) | GRIN1ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL4341044 | 0.83 | CYP1A2 (0.49) | GRIN1ALDH1A1HPGDMDM2CYP1A2 | |
| SCHEMBL4345218 | 0.77 | MEN1 (0.54) | GRIN1CYP1A2MEN1LMNAMAPK1 | |
| SCHEMBL9573782 | 0.77 | GRIN2D (0.43) | GRIN1HPGDCYP1A2MEN1BLM | |
| SCHEMBL9573817 | 0.74 | CA12 (0.38) | GRIN1HPGDCYP1A2MEN1BLM | |
| SCHEMBL5774466 | 0.74 | ALOX15 (0.46) | GRIN1HPGDCYP1A2MEN1LMNA | |
| SCHEMBL4337035 | 0.73 | GRIN1 (0.48) | GRIN1ALDH1A1HPGDHTTSMN1; SMN2 | |
| SCHEMBL8545145 | 0.72 | CYP1A2 (0.48) | GRIN1ALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL4339236 | 0.72 | ALOX15 (0.48) | GRIN1ALDH1A1HPGDHTTRAB9A | |
| SCHEMBL4343874 | 0.71 | MEN1 (0.47) | GRIN1CYP1A2MEN1LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501797-B1 | 3-(SUBSTITUTED AMINO)-1H-INDOLE-2-CARBOXYLIC ACID ESTER AND 3-(SUBSTITUTED AMINO)-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID ESTER DERIVATIVES AS INTERLEUKIN-4 GENE EXPRESSION INHIBITORS | AVENTIS PHARMA INC (US) | 2009-08-05 | — | — | EP | claimed |