Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | RARB | P10826 | 6/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | UGT1A7 | Q9HAW7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27885970 | 0.82 | HSD17B3 (0.42) | ALDH1A1TP53SMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL27497391 | 0.81 | KMT2A (0.50) | ALDH1A1TP53SMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL27805776 | 0.81 | ALDH1A1 (0.53) | ALDH1A1TSHRSRD5A2HPGDL3MBTL1 | |
| Terephthalic Acid SCHEMBL9943962 | 0.80 | FFAR3 (0.62) | ALDH1A1TP53TSHRSMN1; SMN2RARB | |
| SCHEMBL13317140 | 0.80 | CES2 (0.52) | TP53SMN1; SMN2HPGDL3MBTL1KMT2A | |
| SCHEMBL27505168 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TP53TSHRRXRARXRB | |
| Terephthalic Acid SCHEMBL1482407 | 0.79 | TSHR (0.71) | ALDH1A1TP53TSHRRXRARXRB | |
| SCHEMBL5458953 | 0.78 | HSD17B3 (0.69) | ALDH1A1TP53TSHRSMN1; SMN2HPGD | |
| SCHEMBL29242629 | 0.78 | ACE2 (0.43) | ALDH1A1TSHRRARBHPGDL3MBTL1 | |
| SCHEMBL21226652 | 0.77 | LMNA (0.45) | ALDH1A1TSHRSMN1; SMN2HPGDL3MBTL1 |
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-101291916-A | 9-aminocarbonyl substituted derivatives of glycylcyclines | WYETH CORP (US) | 2008-10-22 | — | — | CN | claimed |
| CN-101291916-A | 9-aminocarbonyl substituted derivatives of glycylcyclines | WYETH CORP (US) | 2008-10-22 | — | — | CN | disclosed |