Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | CA3 | P07451 | 2/20 | 0.55 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.55 |
| ▸ | CA4 | P22748 | 2/20 | 0.55 |
| ▸ | CA6 | P23280 | 2/20 | 0.55 |
| ▸ | DPP4 | P27487 | 2/20 | 0.55 |
| ▸ | CA5A | P35218 | 2/20 | 0.55 |
| ▸ | CA7 | P43166 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.55 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | TYR | P14679 | 1/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4574723 | 0.98 | HCAR2 (0.53) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL846833 | 0.85 | CYP1A2 (0.75) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL4001354 | 0.85 | CYP1A2 (0.75) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL818742 | 0.85 | CYP1A2 (0.75) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL6570565 | 0.85 | HCAR2 (0.59) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL4186200 | 0.81 | HCAR2 (0.59) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL80571 | 0.81 | CYP1A2 (0.75) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL80570 | 0.81 | CYP1A2 (0.75) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL4186195 | 0.81 | HCAR2 (0.59) | HCAR2CA12AKR1B10CA1CA2 | |
| SCHEMBL11320903 | 0.80 | HCAR2 (0.62) | HCAR2CA12AKR1B10CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008039087-A2 | INDOLINE DERIVATIVES AND USES THEREOF | AUCKLAND UNISERVICES LIMITED (NZ) | 2008-04-03 | — | — | WO | claimed |
| WO-2008039087-A2 | INDOLINE DERIVATIVES AND USES THEREOF | AUCKLAND UNISERVICES LIMITED (NZ) | 2008-04-03 | — | — | WO | disclosed |