Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | EPOR | P19235 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL15966571 | 1.00 | TSHR (0.42) | TSHREPORALDH1A1L3MBTL1LMNA | |
| SCHEMBL17350549 | 0.76 | ABCB1 (0.39) | TSHREPORALDH1A1L3MBTL1LMNA | |
| SCHEMBL2456291 | 0.72 | KMT2A (0.48) | EPORALDH1A1L3MBTL1LMNAPOLB | |
| SCHEMBL3223085 | 0.71 | TSHR (0.69) | TSHRALDH1A1L3MBTL1LMNAPOLB | |
| SCHEMBL27655077 | 0.71 | ALDH1A1 (0.47) | TSHRALDH1A1L3MBTL1LMNAPOLB | |
| SCHEMBL7023844 | 0.70 | CASR (0.43) | TSHRALDH1A1L3MBTL1LMNAKMT2A | |
| SCHEMBL25181400 | 0.69 | EPOR (0.52) | EPORALDH1A1L3MBTL1LMNAPOLB | |
| SCHEMBL12671106 | 0.68 | TSHR (0.65) | TSHRALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL13434071 | 0.68 | KMT2A (0.70) | ALDH1A1L3MBTL1LMNAPOLBHSD17B10 | |
| SCHEMBL24991861 | 0.66 | EPOR (0.58) | EPORALDH1A1L3MBTL1LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2957555-A1 | METHOD FOR MODIFYING DERIVATIVES OF AMINO ACIDS AND PEPTIDES, COMPOUNDS PRODUCED, AND USE | Consejo Superior De Investigaciones Científicas (CSIC) (ES) | 2015-12-23 | — | — | EP | disclosed |
| WO-2014125145-A1 | METHOD FOR MODIFYING DERIVATIVES OF AMINO ACIDS AND PEPTIDES, COMPOUNDS PRODUCED, AND USE | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2014-08-21 | — | — | WO | disclosed |