Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | SYK | P43405 | 1/20 | 0.49 |
| ▸ | ELANE | P08246 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31053285 | 0.82 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2ELANETSHRKDM4E | |
| SCHEMBL20951865 | 0.81 | THRB (0.47) | SMN1; SMN2ELANETSHRKDM4EL3MBTL1 | |
| SCHEMBL5669102 | 0.80 | TSHR (0.54) | ALDH1A1ELANETSHRHTTL3MBTL1 | |
| SCHEMBL1982592 | 0.78 | MEN1 (0.47) | ALDH1A1SMN1; SMN2ELANEKDM4EHTT | |
| SCHEMBL29523397 | 0.76 | NUDT1 (0.57) | ALDH1A1SMN1; SMN2TSHRKDM4EL3MBTL1 | |
| SCHEMBL1768671 | 0.76 | NUDT1 (0.57) | ALDH1A1SMN1; SMN2TSHRKDM4EL3MBTL1 | |
| SCHEMBL5401801 | 0.75 | TSHR (0.59) | ALDH1A1SMN1; SMN2ELANETSHRTDP1 | |
| SCHEMBL17838975 | 0.75 | SYK (0.46) | SMN1; SMN2SYKKDM4ETDP1HTT | |
| SCHEMBL2918797 | 0.74 | KDM4E (0.67) | ALDH1A1SMN1; SMN2TSHRKDM4ETDP1 | |
| SCHEMBL1161019 | 0.74 | ELANE (0.46) | ALDH1A1ELANETSHRKDM4EHTT |
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-2016202898-A1 | GLUCOSE TRANSPORT INHIBITORS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2016-12-22 | — | — | WO | disclosed |