Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 3/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.49 |
| ▸ | CA7 | P43166 | 3/20 | 0.49 |
| ▸ | CA9 | Q16790 | 3/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 4/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9437191 | 0.89 | CA12 (0.61) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL9437187 | 0.89 | CA12 (0.61) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL39298 | 0.84 | CA12 (0.67) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL9724886 | 0.84 | CA12 (0.67) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL9617127 | 0.83 | PDCD1 (0.42) | MEN1RAB9AKMT2ACA12CA1 | |
| SCHEMBL8957008 | 0.80 | ALDH1A1 (0.50) | MEN1NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL8956744 | 0.80 | ALDH1A1 (0.50) | MEN1NPC1RAB9AKMT2AALDH1A1 | |
| Phenol SCHEMBL3274652 | 0.79 | CA12 (0.59) | NPC1CA12CA1CA2CA7 | |
| SCHEMBL7793973 | 0.79 | CA1 (0.65) | MEN1NPC1RAB9AKMT2ACA12 | |
| SCHEMBL7795432 | 0.79 | CA1 (0.65) | MEN1NPC1RAB9AKMT2ACA12 |
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-4217670-A | — | — | None | — | — | JP | disclosed |
| JP-H04217670-A | ESTER DERIVATIVE | ARAKAWA CHEM IND CO LTD | 1992-08-07 | — | — | JP | disclosed |