Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | UBE2N | P61088 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 2/20 | 0.40 |
| ▸ | PDE1A | P54750 | 2/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29490198 | 1.00 | BRD4 (0.45) | BRD4NPC1RAB9ANR1I2LMNA | |
| SCHEMBL29490219 | 0.91 | BRD4 (0.46) | BRD4NPC1RAB9ALMNAHTT | |
| SCHEMBL22862657 | 0.81 | CSF1R (0.47) | BRD4NR1I2LMNAHTTKCNH2 | |
| SCHEMBL38653371 | 0.81 | CSF1R (0.47) | BRD4NR1I2LMNAHTTKCNH2 | |
| SCHEMBL29490334 | 0.80 | SMN1; SMN2 (0.45) | NR1I2LMNAHTTSMN1; SMN2TSHR | |
| SCHEMBL17149349 | 0.79 | CYP11B1 (0.64) | BRD4NPC1RAB9ANR1I2LMNA | |
| SCHEMBL22862663 | 0.78 | PDE2A (0.42) | NR1I2LMNAHTTSMN1; SMN2TSHR | |
| SCHEMBL29490209 | 0.78 | PDE2A (0.42) | NR1I2LMNAHTTSMN1; SMN2TSHR | |
| SCHEMBL15206007 | 0.76 | CYP11B1 (0.66) | BRD4NR1I2LMNAHTTSMN1; SMN2 | |
| SCHEMBL22862442 | 0.75 | NTRK1 (0.41) | BRD4LMNAHTTKCNH2SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021002986-A2 | BAX INHIBITORS AND USES THEREOF | CASE WESTERN RESERVE UNIVERSITY (US) | 2021-01-07 | — | — | WO | disclosed |