Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NT5E | P21589 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 8/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA6 | P23280 | 2/20 | 0.40 |
| ▸ | CA5A | P35218 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17541809 | 0.83 | TSHR (0.46) | TSHRKCNJ1KCNH2ALDH1A1TDP1 | |
| SCHEMBL11583429 | 0.81 | LMNA (0.56) | LMNATSHRKCNH2ALDH1A1NT5E | |
| SCHEMBL27889544 | 0.80 | LMNA (0.46) | LMNATSHRKCNJ1KCNH2ALDH1A1 | |
| SCHEMBL4930091 | 0.79 | TSHR (0.61) | TSHRKCNJ1KCNH2ALDH1A1CA2 | |
| SCHEMBL27422881 | 0.78 | LMNA (0.45) | LMNATSHRKCNJ1KCNH2ALDH1A1 | |
| SCHEMBL4543334 | 0.78 | ESR1 (0.54) | LMNATSHRALDH1A1CA2TDP1 | |
| SCHEMBL12708608 | 0.78 | TSHR (0.48) | TSHRKCNJ1KCNH2ALDH1A1CA2 | |
| SCHEMBL30446884 | 0.77 | CA2 (0.57) | LMNATSHRALDH1A1NT5ECA2 | |
| SCHEMBL1804175 | 0.75 | LMNA (0.50) | LMNATSHRALDH1A1NT5ECA2 | |
| SCHEMBL16350024 | 0.75 | LMNA (0.50) | LMNATSHRALDH1A1NT5ECA2 |
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-4426291-A | Solvent extraction of nitrated organic compounds from aqueous solutions | BASF WYANDOTTE CORPORATION (US) | 1984-01-17 | — | — | US | claimed |
| US-4426291-A | Solvent extraction of nitrated organic compounds from aqueous solutions | BASF WYANDOTTE CORPORATION (US) | 1984-01-17 | — | — | US | disclosed |