Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | DAO | P14920 | 2/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL6959233 | 0.83 | CYP1A2 (0.48) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL27938396 | 0.80 | TDP1 (0.48) | SLC6A2SLC6A4SLC6A3CYP1A2CYP2A6 | |
| SCHEMBL8430543 | 0.80 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL8499344 | 0.80 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL8499350 | 0.80 | KDM4E (0.45) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL8253244 | 0.77 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL30843262 | 0.77 | CYP1A2 (0.50) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL2287085 | 0.77 | CYP1A2 (0.50) | SLC6A2SLC6A4SLC6A3KCNH2CYP19A1 | |
| SCHEMBL30985268 | 0.77 | CYP1A2 (0.56) | SLC6A4CYP1A2CYP2A6TDP1SIGMAR1 | |
| SCHEMBL314040 | 0.77 | CYP1A2 (0.56) | SLC6A4CYP1A2CYP2A6TDP1SIGMAR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5105020-A | Lopoxygerase inhibitors; antiinflammatory agents, antiallergens | IMPERIAL CHEMISTRIES INDUSTRIES PLC (GB) | 1992-04-14 | — | — | US | disclosed |