Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | CA7 | P43166 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | CES1 | P23141 | 5/20 | 0.46 |
| ▸ | FAAH | O00519 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | POLA1 | P09884 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | KDM5A | P29375 | 1/20 | 0.42 |
| ▸ | DGKA | P23743 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17070325 | 0.91 | CA12 (0.51) | CA12CA14CA2CA7CA9 | |
| SCHEMBL9162896 | 0.85 | CES1 (0.46) | CA12CA14CA2CA7CA9 | |
| SCHEMBL179777 | 0.85 | CES1 (0.46) | CA12CA14CA2CA7CA9 | |
| SCHEMBL9165506 | 0.85 | CES1 (0.46) | CA12CA14CA2CA7CA9 | |
| SCHEMBL4145774 | 0.85 | CES1 (0.46) | CA12CA14CA2CA7CA9 | |
| SCHEMBL9159830 | 0.85 | CES1 (0.46) | CA12CA14CA2CA7CA9 | |
| SCHEMBL14987833 | 0.85 | TSHR (0.54) | CA12CA14CA2CA7CA9 | |
| SCHEMBL17817589 | 0.84 | CA12 (0.48) | CA12CA14CA2CA7CA9 | |
| SCHEMBL11088316 | 0.84 | CA12 (0.48) | CA12CA14CA2CA7CA9 | |
| SCHEMBL4296011 | 0.83 | FAAH (0.56) | CA12CA14CA2CA7CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7385086-B2 | Antimicrobial compounds | THE JOHNS HOPKINS UNIVERSITY SCHOOL OF MEDICINE (US) | 2008-06-10 | — | — | US | disclosed |