Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDFT1 | P37268 | 1/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4003420 | 0.94 | CA12 (0.59) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL21656823 | 0.86 | MAPT (0.53) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL3289949 | 0.86 | LMNA (0.54) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL1789154 | 0.86 | ALDH1A1 (0.63) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL17389542 | 0.85 | FDFT1 (0.58) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL604022 | 0.84 | ESR2 (0.49) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL13437221 | 0.84 | RAB9A (0.51) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL601278 | 0.84 | ESR2 (0.49) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL25340952 | 0.83 | RAB9A (0.54) | FDFT1ESR2CA12CA1CA2 | |
| SCHEMBL15231562 | 0.83 | ESR2 (0.51) | FDFT1ESR2CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102924445-B | PIM kinase inhibitor, preparation method thereof, and application thereof in pharmacy | SHANGHAI JIKAI MEDICAL TECHNOLOGY CO LTD | 2015-07-08 | — | — | CN | disclosed |