Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 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 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28065967 | 0.98 | TSHR (0.40) | TSHRTP53MAPTSRD5A2CA1 | |
| SCHEMBL28005995 | 0.98 | TSHR (0.40) | TSHRTP53MAPTSRD5A2CA1 | |
| SCHEMBL28044876 | 0.98 | TSHR (0.40) | TSHRTP53MAPTSRD5A2CA1 | |
| SCHEMBL28013539 | 0.98 | TSHR (0.40) | TSHRTP53MAPTSRD5A2CA1 | |
| Sulfuric Acid SCHEMBL28590325 | 0.94 | TP53 (0.36) | TSHRTP53MAPTSRD5A2CA1 | |
| SCHEMBL27990722 | 0.93 | HSD17B10 (0.38) | MAPTALDH1A1HPGDALOX15SMN1; SMN2 | |
| SCHEMBL28015157 | 0.91 | HSD17B10 (0.37) | MAPTALDH1A1HPGDALOX15SMN1; SMN2 | |
| SCHEMBL17495602 | 0.88 | KMT2A (0.45) | TSHRTP53MAPTALDH1A1HPGD | |
| Sulfuric Acid SCHEMBL28600605 | 0.86 | MAPT (0.36) | MAPTSMN1; SMN2HSD17B10KMT2A | |
| Sulfuric Acid SCHEMBL28590324 | 0.86 | MAPT (0.36) | MAPTSMN1; SMN2HSD17B10KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105254577-B | A kind of pair of triazole substituted benzene diformic ester compound, preparation method and purposes | 常州大学 | 2017-08-01 | — | — | CN | disclosed |
| CN-105254577-A | Bis-triazole-substituted terephthalate compound and its preparation method and use | UNIV CHANGZHOU | 2016-01-20 | — | — | CN | disclosed |