Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | TPMT | P51580 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11342136 | 0.80 | TSHR (0.42) | KDM4EHPGDTSHRKMT2ATPMT | |
| SCHEMBL15615318 | 0.77 | CA12 (0.56) | KMT2AL3MBTL1MEN1LMNACYP1A2 | |
| SCHEMBL11325769 | 0.77 | TPMT (0.40) | KDM4EALDH1A1HPGDKMT2ATPMT | |
| SCHEMBL13606921 | 0.73 | NPC1 (0.54) | ALDH1A1HPGDTSHRKMT2AL3MBTL1 | |
| SCHEMBL29082970 | 0.71 | TSHR (0.46) | KDM4EALDH1A1HPGDTSHRKMT2A | |
| SCHEMBL8427325 | 0.71 | TPMT (0.46) | ALDH1A1HPGDKMT2ATPMTL3MBTL1 | |
| SCHEMBL10498221 | 0.70 | ALDH1A1 (0.47) | KDM4EALDH1A1TSHRKMT2AL3MBTL1 | |
| SCHEMBL668260 | 0.70 | TPMT (0.44) | HPGDTPMTKDR | |
| SCHEMBL2172133 | 0.70 | TPMT (0.70) | ALDH1A1TSHRTPMTKDRSMN1; SMN2 | |
| SCHEMBL2172128 | 0.70 | TPMT (0.44) | HPGDTPMTKDR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1015430-A4 | SPIRO PYRROLIDINE-2,3'-OXINDOLE] COMPOUNDS AND METHODS OF USE | ARQULE INC (US) | 2001-01-17 | — | — | EP | disclosed |
| EP-1015430-A1 | SPIRO PYRROLIDINE-2,3'-OXINDOLE] COMPOUNDS AND METHODS OF USE | ARQULE, INC. (US) | 2000-07-05 | — | — | EP | disclosed |
| WO-1999012904-A1 | SPIRO[PYRROLIDINE-2,3'-OXINDOLE] COMPOUNDS AND METHODS OF USE | ARQULE, INC. (US) | 1999-03-18 | — | — | WO | disclosed |