Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.44 |
| ▸ | PNMT | P11086 | 3/20 | 0.41 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.40 |
| ▸ | ABAT | P80404 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | IAPP | P10997 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20182944 | 0.83 | GABRA1 (0.55) | GABRA1GABRB2PNMTHMGB1ABAT | |
| SCHEMBL366656 | 0.76 | ADAMTS4 (0.52) | GABRA1GABRB2PNMTTAAR1IAPP | |
| SCHEMBL5184014 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL1998632 | 0.74 | ADAMTS4 (0.50) | GABRA1GABRB2PNMTTAAR1IAPP | |
| SCHEMBL2019654 | 0.74 | MMP2 (0.43) | GABRA1GABRB2PNMTHMGB1ABAT | |
| SCHEMBL24349403 | 0.74 | GABRA1 (0.46) | GABRA1GABRB2PNMTHMGB1ABAT | |
| Bromide SCHEMBL622788 | 0.74 | ADAMTS4 (0.50) | GABRA1GABRB2PNMTTAAR1IAPP | |
| SCHEMBL14764373 | 0.74 | AKR1B1 (0.57) | GABRA1GABRB2HMGB1KDM4E | |
| SCHEMBL14645911 | 0.74 | HMGB1 (0.55) | GABRA1GABRB2PNMTHMGB1IAPP | |
| SCHEMBL11763142 | 0.73 | TAAR1 (0.50) | GABRA1GABRB2PNMTHMGB1ABAT |
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-2013034119-A1 | 4-METHYLCATECHOL DERIVATIVES UND USE THEREOF | Thanares GmbH (DE) | 2013-03-14 | — | — | WO | claimed |
| WO-2013034119-A1 | 4-METHYLCATECHOL DERIVATIVES UND USE THEREOF | Thanares GmbH (DE) | 2013-03-14 | — | — | WO | disclosed |