Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14764447 | 0.82 | MAPT (0.38) | PNMTSMN1; SMN2NPSR1ALDH1A1KDM4E | |
| SCHEMBL4895058 | 0.78 | SCN4A (0.43) | PNMTTAAR1LMNA | |
| SCHEMBL622628 | 0.78 | CA12 (0.53) | CA12CA1CA2CA14TAAR1 | |
| SCHEMBL11436863 | 0.78 | ALDH1A1 (0.40) | PNMTCA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL23218712 | 0.76 | IDO1 (0.42) | PNMTTAAR1IDO1ALDH1A1GAA | |
| SCHEMBL16390903 | 0.76 | SLC6A2 (0.43) | PNMTTAAR1PDCD1LG2CD274IDO1 | |
| SCHEMBL14292479 | 0.76 | TAAR1 (0.41) | PNMTCA12CA1CA2CA14 | |
| SCHEMBL641422 | 0.76 | PNMT (0.57) | PNMTTAAR1PDCD1LG2CD274IDO1 | |
| Hydrochloric Acid SCHEMBL5485820 | 0.76 | CA12 (0.51) | CA12CA1CA2CA14TAAR1 | |
| SCHEMBL774014 | 0.76 | CA1 (0.47) | PNMTCA12CA1CA2CA14 |
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 |