Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.68 |
| ▸ | PNMT | P11086 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | GLA | P06280 | 1/20 | 0.65 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Methylamine SCHEMBL6500291 | 0.95 | PNMT (0.69) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL423182 | 0.85 | CYP1A2 (0.68) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL11501928 | 0.83 | CYP1A2 (0.65) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL8207792 | 0.81 | PNMT (1.00) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL158333 | 0.81 | PNMT (1.00) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL8428077 | 0.81 | CYP1A2 (0.63) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL10980261 | 0.81 | CYP1A2 (0.63) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL15302407 | 0.81 | CYP1A2 (0.63) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL8207165 | 0.81 | PNMT (1.00) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 | |
| SCHEMBL7546175 | 0.81 | CYP1A2 (0.63) | CYP1A2PNMTCYP3A4CYP2D6NFKB1 |
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-11154525-B2 | Purified compositions of polyunsaturated fatty acids, their preparation method and their use | BRUZZESE TIBERIO (IT) | 2021-10-26 | — | — | US | claimed |
| US-20200397734-A1 | PURIFIED COMPOSITIONS OF POLYUNSATURATED FATTY ACIDS, THEIR PREPARATION METHOD AND THEIR USE | BRUZZESE TIBERIO (IT) | 2020-12-24 | — | — | US | claimed |