Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GSR | P00390 | 1/20 | 0.34 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | GCGR | P47871 | 1/20 | 0.30 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27326696 | 0.82 | TSHR (0.43) | TSHRALDH1A1GSRTXNRD1TDP1 | |
| SCHEMBL411439 | 0.79 | — | — | |
| SCHEMBL20969967 | 0.77 | KEAP1 (0.34) | TSHRTDP1 | |
| SCHEMBL28725204 | 0.75 | TSHR (0.52) | TSHRALDH1A1TDP1SMN1; SMN2MEN1 | |
| SCHEMBL27281706 | 0.74 | TSHR (0.41) | TSHRALDH1A1TDP1KDM4E | |
| SCHEMBL28079002 | 0.73 | KEAP1 (0.36) | — | |
| 1,4-Dichlorobenzene SCHEMBL27658292 | 0.72 | ALDH1A1 (0.60) | TSHRALDH1A1TDP1SMN1; SMN2NPC1 | |
| SCHEMBL27967954 | 0.71 | TSHR (0.43) | TSHRALDH1A1GSRTXNRD1TDP1 | |
| SCHEMBL27715304 | 0.71 | TSHR (0.52) | TSHRALDH1A1TDP1SMN1; SMN2MEN1 | |
| SCHEMBL5749103 | 0.69 | KCNH2 (0.41) | TSHRGSRTXNRD1TDP1MEN1 |
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-101899044-B | Method for synthesizing Gemifloxacin main ring compound | CHANGZHOU YONGYI BIO PHARMACEUTICAL CO LTD | 2012-07-18 | — | — | CN | disclosed |
| CN-101899044-A | Method for synthesizing Gemifloxacin main ring compound | CHANGZHOU YONGYI BIO PHARMACEUTICAL CO LTD | 2010-12-01 | — | — | CN | disclosed |