Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 3/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | DNM2 | P50570 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL10627509 | 1.00 | NOS2 (0.45) | NOS2SIGMAR1DNM2ALDH1A1TSHR | |
| SCHEMBL16228218 | 0.83 | NOS2 (0.58) | NOS2DNM2NOS3NOS1KCNH2 | |
| SCHEMBL11829782 | 0.75 | NOS2 (0.64) | NOS2NOS3NOS1 | |
| SCHEMBL1188212 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 | |
| SCHEMBL1188113 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 | |
| SCHEMBL1187601 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 | |
| SCHEMBL1187340 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 | |
| SCHEMBL1187021 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 | |
| SCHEMBL1187537 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 | |
| SCHEMBL1187329 | 0.74 | NOS2 (0.63) | NOS2NOS3NOS1KCNH2 |
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-4871848-A | OIL, GAS WELLS CORROSION INHIBITORS | THE DOW CHEMICAL COMPANY (US) | 1989-10-03 | — | — | US | disclosed |
| US-4740320-A | REACTION OF NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPONENT, KETONE OR ALDEHYDE, AMINE OR POLYAMINE | THE DOW CHEMICAL COMPANY (US) | 1988-04-26 | — | — | US | disclosed |