Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ESRRG | P62508 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5593599 | 0.84 | CYP1A2 (0.51) | CYP1A2FFAR4LMNAKDM4EALDH1A1 | |
| SCHEMBL5593715 | 0.84 | MAPT (0.47) | CYP1A2LMNAKDM4EALDH1A1HPGD | |
| SCHEMBL9670503 | 0.82 | CYP1A2 (0.67) | CYP1A2FFAR4LMNAKDM4ETP53 | |
| SCHEMBL3679227 | 0.81 | THRA (0.67) | THRATHRBFFAR4ALDH1A1HPGD | |
| SCHEMBL1747380 | 0.76 | FFAR1 (0.58) | FFAR4FFAR1L3MBTL1 | |
| SCHEMBL10312503 | 0.76 | FFAR1 (0.57) | CYP1A2FFAR4ALDH1A1FFAR1 | |
| SCHEMBL1217683 | 0.75 | CYP1A2 (0.80) | CYP1A2FFAR4FFAR1 | |
| SCHEMBL30403190 | 0.75 | CYP1A2 (0.80) | CYP1A2FFAR4FFAR1 | |
| SCHEMBL12889161 | 0.75 | CYP1A2 (0.59) | CYP1A2FFAR4LMNAKDM4ETP53 | |
| SCHEMBL14810684 | 0.74 | SMN1; SMN2 (0.67) | LMNAALDH1A1HPGDHSD17B10MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007022263-A1 | FLUOROGENIC PROBES FOR MEDIUM CHAIN ACYL-COA DEHYDROGENASE ( MCAD ) | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2007-02-22 | — | — | WO | disclosed |
| WO-2007022263-A1 | FLUOROGENIC PROBES FOR MEDIUM CHAIN ACYL-COA DEHYDROGENASE ( MCAD ) | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2007-02-22 | — | — | WO | disclosed |