Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9188228 | 0.89 | IDO1 (0.36) | AGXTCA2CA9IDO1CYP1A2 | |
| SCHEMBL11265351 | 0.83 | RXRA (0.40) | RAB9ANPC1ALDH1A1MAPK1CYP2A6 | |
| SCHEMBL11232686 | 0.80 | IDO1 (0.52) | AGXTCA1CA2RAB9ANPC1 | |
| SCHEMBL11233127 | 0.79 | AGXT (0.48) | AGXTCA1CA2CA9RAB9A | |
| SCHEMBL11224068 | 0.79 | IDO1 (0.48) | AGXTCA1CA2CA9MAOB | |
| SCHEMBL872358 | 0.78 | TSHR (0.48) | AGXTCA1CA2CA9RAB9A | |
| SCHEMBL27928207 | 0.77 | FFAR1 (0.52) | AGXTCA1CA2CA9RAB9A | |
| SCHEMBL11232955 | 0.77 | NQO1 (0.50) | RAB9ANPC1PARP10FFAR1ALDH1A1 | |
| SCHEMBL29599465 | 0.76 | AGXT (0.54) | AGXTCA1CA2CA9RAB9A | |
| SCHEMBL407132 | 0.76 | AGXT (0.54) | AGXTCA1CA2CA9RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4360464-A | Process for production of 1-aryloxy-aminopropane derivatives | TEIKOKU HORMONE MFG. CO. LTD. (JP) | 1982-11-23 | — | — | US | disclosed |
| US-4018824-A | ANTIULCER AND ADRENERGIC BLOCKING AGENTS | TEIKOKU HORMONE MFG. CO., LTD. (JA) | 1977-04-19 | — | — | US | disclosed |