Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD52 | P43351 | 1/20 | 0.63 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.48 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.48 |
| ▸ | TUBB | P07437 | 1/20 | 0.48 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.48 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.48 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.48 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.48 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.48 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.48 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.48 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28118851 | 0.96 | RAD52 (0.67) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL30159718 | 0.86 | CA12 (0.56) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL28118318 | 0.86 | CA12 (0.56) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL12268988 | 0.84 | CYP2A6 (0.60) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL27902298 | 0.84 | CYP2A6 (0.65) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL27881860 | 0.83 | RAD52 (0.56) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL12269009 | 0.82 | CYP2A6 (0.58) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL12259995 | 0.82 | CYP2A6 (0.62) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL3137389 | 0.82 | CYP2A6 (0.62) | RAD52CA12CA1CA2CA7 | |
| SCHEMBL8558574 | 0.82 | CA12 (0.65) | RAD52CA12CA1CA2CA7 |
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-102796097-B | Phenanthroindolizididerivative pyridine alcaloid-derivatives, its preparation method and pharmaceutical composition and purposes | INSTITUTE OF MATARIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2016-12-14 | — | — | CN | claimed |
| CN-102796097-B | Phenanthroindolizididerivative pyridine alcaloid-derivatives, its preparation method and pharmaceutical composition and purposes | INSTITUTE OF MATARIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2016-12-14 | — | — | CN | disclosed |