Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17560402 | 0.81 | ALDH1A1 (0.38) | ALDH1A1GAATSHRSMN1; SMN2POLB | |
| SCHEMBL2223429 | 0.80 | TSHR (0.63) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| SCHEMBL3635136 | 0.80 | TSHR (0.63) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| SCHEMBL17560382 | 0.79 | ALDH1A1 (0.41) | ALDH1A1GAATSHRSMN1; SMN2POLB | |
| SCHEMBL11488922 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| SCHEMBL11402027 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| SCHEMBL1292196 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| SCHEMBL21138457 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| Hydrochloric Acid SCHEMBL19031025 | 0.78 | TSHR (0.61) | ALDH1A1KDM4ETHRBATML3MBTL1 | |
| SCHEMBL8710504 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KDM4ETHRBATML3MBTL1 |
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-2016034134-A1 | HETEROAROMATIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-03-10 | — | — | WO | disclosed |