Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.83 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.83 |
| ▸ | TSHR | P16473 | 2/20 | 0.83 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.83 |
| ▸ | HTR3A | P46098 | 1/20 | 0.83 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.80 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.80 |
| ▸ | APEX1 | P27695 | 3/20 | 0.80 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.80 |
| ▸ | BLM | P54132 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | RECQL | P46063 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Octopamine SCHEMBL1650462 | 0.91 | TAAR1 (1.00) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL22605 | 0.91 | TAAR1 (1.00) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL3489184 | 0.91 | TAAR1 (1.00) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL1168914 | 0.89 | TDP1 (1.00) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL17688531 | 0.89 | TAAR1 (0.95) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL30782000 | 0.89 | TDP1 (1.00) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL5458985 | 0.89 | TAAR1 (0.95) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| Octopamine SCHEMBL4282037 | 0.89 | TAAR1 (0.95) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| SCHEMBL2021 | 0.89 | TAAR1 (0.62) | TAAR1HIF1ATSHRNFKB1HTR3A | |
| SCHEMBL147501 | 0.89 | TAAR1 (0.62) | TAAR1HIF1ATSHRNFKB1HTR3A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5935953-A | TROPANE DERIVATIVES AS INHIBITORS TO REDUCE THE FEEDING OF AND DELAYING THE MATURATION OF THE INSECTS AND PESTS; INHIBITORS OF A PHENYLETHANOLAMINE, E.G.OCTOPAMINE, REUPTAKE TRANSPORTER; PESTICIDES; PESTISTATS; INSECTICIDES | RESEARCH TRIANGLE INSTITUTE (US) | 1999-08-10 | — | — | US | disclosed |
| US-5366975-A | Pesticides | THE GENERAL HOSPITAL CORPORATION (US) | 1994-11-22 | — | — | US | disclosed |
| WO-1993000811-A1 | INVERTEBRATE PHENYLETHANOLAMINE TRANSPORTER AND THE USE THEREOF | THE GENERAL HOSPITAL CORPORATION (US) | 1993-01-21 | — | — | WO | disclosed |