Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NCF1 | P14598 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6543474 | 0.85 | NCF1 (0.48) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL31665931 | 0.79 | NCF1 (0.46) | TSHRNCF1CYP1A2NOS2BACE1 | |
| SCHEMBL3294200 | 0.79 | NCF1 (0.46) | TSHRNCF1CYP1A2NOS2BACE1 | |
| SCHEMBL11265937 | 0.78 | NCF1 (0.42) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL28919631 | 0.76 | NCF1 (0.43) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL28700794 | 0.73 | CYP1A2 (0.39) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL4379432 | 0.73 | KCNN4 (0.48) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL28783629 | 0.73 | CYP1A2 (0.45) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL11795759 | 0.72 | NCF1 (0.43) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL537850 | 0.72 | NCF1 (0.43) | NCF1CYP1A2NOS2BACE1CA12 |
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-4404345-A | UNSATURATED CARBOXYL MONOMER, HALOGENATED PROMOTER, POLYMERIZATION INHIBITOR WITH REALTION PRODUCT OF ALDEHYDE AND AMINE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1983-09-13 | — | — | US | claimed |