Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SLC6A5 | Q9Y345 | 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 | |
|---|---|---|---|---|
| SCHEMBL18063149 | 0.99 | TACR1 (0.43) | TACR1CYP4F2CYP4A11ALDH1A1TSHR | |
| SCHEMBL21501012 | 0.94 | TACR1 (0.47) | TACR1ALDH1A1TSHRSMN1; SMN2MAPT | |
| SCHEMBL19839372 | 0.86 | MAPT (0.41) | TACR1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL26648920 | 0.86 | CYP4F2 (0.46) | CYP4F2CYP4A11ALDH1A1CTSLCTSB | |
| SCHEMBL19839917 | 0.85 | KDM4E (0.49) | ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL24859871 | 0.84 | TACR1 (0.51) | TACR1ALDH1A1TSHR | |
| SCHEMBL2435076 | 0.83 | TACR1 (0.48) | TACR1ALDH1A1TSHRCTSLCTSB | |
| SCHEMBL17041034 | 0.83 | OPRL1 (0.41) | TACR1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL9875164 | 0.83 | KDM4E (0.50) | ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL30200387 | 0.82 | CYP4F2 (0.49) | CYP4F2CYP4A11ALDH1A1CTSLCTSB |
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-2013056679-A1 | NOVEL HETEROARYL-AMINO DERIVATIVES | BEIJING HANMI PHARMACEUTICAL CO., LTD (CN) | 2013-04-25 | — | — | WO | disclosed |
| WO-2013056679-A1 | NOVEL HETEROARYL-AMINO DERIVATIVES | BEIJING HANMI PHARMACEUTICAL CO., LTD (CN) | 2013-04-25 | — | — | WO | disclosed |