Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | DTYMK | P23919 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL29674762 | 1.00 | L3MBTL1 (0.54) | L3MBTL1TDP1CASP6GAAHTT | |
| SCHEMBL3826317 | 0.86 | TDP1 (0.62) | L3MBTL1TDP1CASP6TSHRCA1 | |
| Pyridine SCHEMBL4763738 | 0.85 | TSHR (0.55) | L3MBTL1TDP1CASP6GAAHTT | |
| Pyridine SCHEMBL11046519 | 0.78 | ALDH1A1 (0.52) | L3MBTL1TDP1GAAHTTNCOA1 | |
| SCHEMBL1554602 | 0.78 | TDP1 (0.75) | L3MBTL1TDP1CASP6TSHRCA1 | |
| SCHEMBL3260821 | 0.77 | TDP1 (0.53) | L3MBTL1TDP1CASP6GAATSHR | |
| Pyridine SCHEMBL11707806 | 0.76 | CA1 (0.56) | TDP1HTTCA1CA2ALDH1A1 | |
| SCHEMBL21749965 | 0.76 | TDP1 (0.51) | L3MBTL1TDP1CASP6HTTSMN1; SMN2 | |
| SCHEMBL11644545 | 0.76 | LMNA (0.56) | L3MBTL1TDP1CASP6TSHRCA1 | |
| SCHEMBL16862931 | 0.76 | TDP1 (0.52) | L3MBTL1TDP1CASP6GAAHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004076425-A1 | IMPROVED SYNTHESIS OF MACROCYCLIC TETRAAMIDO COMPOUNDS AND NEW METAL INSERTION PROCESS | CARNEGIE MELLON UNIVERSITY (US) | 2004-09-10 | — | — | WO | disclosed |