Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | TACR3 | P29371 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 2/20 | 0.33 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.33 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9432807 | 0.75 | AKR1B1 (0.46) | AKR1B1SMN1; SMN2KIF11CTNNB1 | |
| SCHEMBL167946 | 0.72 | AKR1B1 (0.47) | KMT2AAKR1B1SMN1; SMN2HTTTSHR | |
| SCHEMBL29579029 | 0.72 | AKR1B1 (0.47) | KMT2AAKR1B1SMN1; SMN2HTTTSHR | |
| SCHEMBL20480313 | 0.71 | MAPT (0.39) | KMT2ATACR1TACR3SCN9A | |
| SCHEMBL28891468 | 0.70 | AKR1B1 (0.45) | KMT2AAKR1B1SMN1; SMN2HTTKIF11 | |
| SCHEMBL29430297 | 0.70 | AKR1B1 (0.45) | KMT2AAKR1B1SMN1; SMN2HTTKIF11 | |
| SCHEMBL24543482 | 0.68 | KMT2A (0.33) | KMT2ATACR1TACR3SMN1; SMN2KIF11 | |
| SCHEMBL9432149 | 0.68 | AKR1B1 (0.43) | TACR1TACR3AKR1B1HTTKIF11 | |
| SCHEMBL24543269 | 0.67 | KMT2A (0.33) | KMT2ATACR1TACR3KIF11 | |
| SCHEMBL11886853 | 0.67 | AKR1B1 (0.47) | KMT2AAKR1B1SMN1; SMN2HTTCYP26A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0530198-A1 | HETEROCYCLIC COMPOUNDS AS ALDOSE REDUCTASE INHIBITORS | PFIZER INC. (US) | 1993-03-10 | — | — | EP | disclosed |
| WO-1991015491-A1 | HETEROCYCLIC COMPOUNDS AS ALDOSE REDUCTASE INHIBITORS | PFIZER INC. (US) | 1991-10-17 | — | — | WO | disclosed |