Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 6/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 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 | |
|---|---|---|---|---|
| SCHEMBL8017279 | 0.96 | HTR7 (0.46) | HTR7ADRB2ADRB1MAPK1TP53 | |
| SCHEMBL27515199 | 0.94 | HTR7 (0.44) | HTR7ADRB2ADRB1MAPK1TP53 | |
| Hydrogen Sulfide SCHEMBL27894468 | 0.90 | HTR7 (0.42) | HTR7ADRB2ADRB1MAPK1TP53 | |
| SCHEMBL12355661 | 0.83 | CA12 (0.39) | HTR7MAPK1L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL22174608 | 0.80 | HTR7 (0.43) | HTR7ADRB2ADRB1MAPK1TP53 | |
| SCHEMBL27460371 | 0.77 | ADRB2 (0.46) | HTR7ADRB2ADRB1MAPK1TP53 | |
| SCHEMBL27335556 | 0.77 | L3MBTL1 (0.49) | ADRB2ADRB1MAPK1NCOA1NCOA3 | |
| SCHEMBL28340902 | 0.77 | LMNA (0.46) | ADRB2ADRB1MAPK1TDP1L3MBTL1 | |
| SCHEMBL7049020 | 0.77 | TAAR1 (0.46) | ADRB2MAPK1TP53RAB9A | |
| SCHEMBL12164572 | 0.76 | KIF11 (0.42) | MAPK1NCOA1NCOA3L3MBTL1KDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1052229-C | 7-deoxy-taxol and pharmaceutical composition thereof | BRISTOL MYERS SQUIBB CO (US) | 2000-05-10 | — | — | CN | disclosed |
| CN-1051309-C | Fluoro taxol | BRISTOL MYERS SQUIBB CO (US) | 2000-04-12 | — | — | CN | disclosed |
| CN-1085553-A | Deoxy taxols | BRISTOL MYERS SQUIBB CO (US) | 1994-04-20 | — | — | CN | disclosed |
| CN-1082541-A | Fluoro taxols | BRISTOL MYERS SQUIBB CO (US) | 1994-02-23 | — | — | CN | disclosed |
| CN-1069028-A | The asymmetric synthesis of taxol side chain | BRISTOL MYERS SQUIBB CO (US) | 1993-02-17 | — | — | CN | disclosed |