Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | FPR2 | P25090 | 5/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27562010 | 0.80 | TDP1 (0.55) | — | |
| SCHEMBL1729493 | 0.79 | EPHX2 (0.54) | EPHX2EPHX1 | |
| Benzene SCHEMBL6243713 | 0.79 | EPHX2 (0.54) | EPHX2EPHX1 | |
| Chlorobenzene SCHEMBL9486505 | 0.74 | ALDH1A1 (0.49) | EPHX1CNR1 | |
| SCHEMBL28194627 | 0.74 | KMT2A (0.62) | — | |
| SCHEMBL19707415 | 0.73 | CA12 (0.68) | CA12CA1CA2CA9TRPV1 | |
| SCHEMBL30003961 | 0.72 | EPHX1 (0.61) | CA2CA9IDO1EPHX2EPHX1 | |
| Chlorobenzene SCHEMBL6238802 | 0.72 | RAB9A (0.50) | EPHX2EPHX1CNR1 | |
| SCHEMBL1092529 | 0.72 | CA12 (0.50) | CA12CA1CA2CA9SIGMAR1 | |
| SCHEMBL2090693 | 0.72 | CA1 (0.50) | CA12CA1CA2CA9SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101541748-A | Methods for treating hepatitis C | PTC THERAPEUTICS INC (US) | 2009-09-23 | — | — | CN | disclosed |