Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL8953477 | 0.92 | NPC1 (0.34) | CA12CA1CA2CA7CA9 | |
| SCHEMBL997634 | 0.81 | KDM4E (0.50) | KDM4EALDH1A1HSD17B10 | |
| Isopropylamine SCHEMBL9565383 | 0.81 | KDM4E (0.44) | KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8809985 | 0.80 | KDM4E (0.49) | KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8809973 | 0.79 | KDM4E (0.37) | NPSR1LMNAKDM4EALDH1A1RAB9A | |
| SCHEMBL2284904 | 0.77 | ALDH1A1 (0.38) | NPSR1LMNAKDM4EALDH1A1RAB9A | |
| Isopropylamine SCHEMBL8953470 | 0.73 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10 | |
| SCHEMBL2290901 | 0.73 | CHRM4 (0.36) | NPSR1KDM4EALDH1A1RAB9ANPC1 | |
| SCHEMBL2288979 | 0.70 | CYP1A2 (0.38) | NPSR1ALDH1A1RAB9ANPC1HSD17B10 | |
| SCHEMBL8802402 | 0.70 | NPSR1 (0.47) | NPSR1LMNAKDM4EALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-5294944-A | — | — | None | — | — | JP | disclosed |
| JP-H05294944-A | SUBSTITUTED PHTHALIDES AND HETEROCYCLIC PHTHALIDES | SANDOZ AG | 1993-11-09 | — | — | JP | disclosed |