Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL27727847 | 0.69 | TSHR (0.41) | TSHRSMN1; SMN2HSD17B10HPGDUSP2 | |
| SCHEMBL10361250 | 0.67 | CHRM2 (0.40) | SMN1; SMN2NPC1RAB9AALDH1A1NPSR1 | |
| Hydrochloric Acid SCHEMBL10361248 | 0.66 | CHRM2 (0.39) | SMN1; SMN2NPC1RAB9AALDH1A1NPSR1 | |
| SCHEMBL6266290 | 0.65 | HDAC1 (0.40) | HSD17B10HPGDCA1CA2ALDH1A1 | |
| Phenylmethanesulfonic Acid SCHEMBL29785797 | 0.65 | ALDH1A1 (0.49) | TSHRSMN1; SMN2HSD17B10HPGDUSP2 | |
| SCHEMBL9322782 | 0.64 | TSHR (0.49) | TSHRSMN1; SMN2HSD17B10HPGDCA1 | |
| SCHEMBL31515163 | 0.63 | TSHR (0.41) | TSHRSMN1; SMN2HSD17B10HPGDUSP2 | |
| SCHEMBL164696 | 0.62 | SIRT1 (0.32) | ALDH1A1 | |
| SCHEMBL8041723 | 0.62 | SIRT1 (0.35) | — | |
| SCHEMBL312941 | 0.62 | TSHR (1.00) | TSHRSMN1; SMN2HSD17B10HPGDCA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104744321-A | Compounds for suppressing a peripheral nerve disorder induced by an anti - cancer agent | TAKEDA PHARMACEUTICAL | 2015-07-01 | — | — | CN | disclosed |