Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 11/20 | 0.51 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4229269 | 0.88 | ALDH1A1 (0.44) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4233329 | 0.87 | ALDH1A1 (0.45) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4370330 | 0.84 | ALDH1A1 (0.43) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4365496 | 0.83 | ALDH1A1 (0.48) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4368995 | 0.83 | ALDH1A1 (0.43) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4368165 | 0.82 | ALDH1A1 (0.45) | P2RX7ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL4369135 | 0.81 | ALDH1A1 (0.46) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4375228 | 0.80 | ALDH1A1 (0.45) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4369230 | 0.80 | ALDH1A1 (0.47) | ALDH1A1POLBMEN1KMT2ARAB9A | |
| SCHEMBL4365434 | 0.80 | UTS2R (0.46) | P2RX7ALDH1A1POLBMEN1KMT2A |
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-2009026248-A2 | HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE | THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) | 2009-02-26 | — | — | WO | claimed |
| WO-2009026248-A2 | HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE | THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) | 2009-02-26 | — | — | WO | disclosed |