Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.44 |
| ▸ | RXRA | P19793 | 2/20 | 0.43 |
| ▸ | RXRB | P28702 | 2/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | BCL2 | P10415 | 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 | |
|---|---|---|---|---|
| SCHEMBL17253128 | 0.81 | LMNA (0.69) | ALDH1A1LMNAABCC4GAATSHR | |
| SCHEMBL6295539 | 0.81 | ABCC4 (0.69) | ALDH1A1LMNAABCC4GAATSHR | |
| SCHEMBL15338388 | 0.79 | NPC1 (0.47) | ALDH1A1EGFRLMNAABCC4GAA | |
| SCHEMBL1702558 | 0.76 | TP53 (0.56) | ALDH1A1EGFRTSHRSMN1; SMN2UCHL1 | |
| SCHEMBL2776957 | 0.76 | TP53 (0.56) | ALDH1A1EGFRTSHRSMN1; SMN2UCHL1 | |
| SCHEMBL6301861 | 0.76 | CYP4F2 (0.59) | ALDH1A1LMNAGAATSHRPLK1 | |
| SCHEMBL155192 | 0.76 | ALDH1A1 (0.52) | ALDH1A1EGFRLMNATSHRPLK1 | |
| SCHEMBL25046253 | 0.76 | CTBP2 (0.52) | ALDH1A1LMNAGAASMN1; SMN2RAB9A | |
| SCHEMBL7147959 | 0.75 | ALDH1A1 (0.56) | ALDH1A1EGFRLMNARXRARXRB | |
| SCHEMBL9420265 | 0.74 | ALDH1A1 (0.61) | ALDH1A1EGFRS1PR1S1PR5RXRA |
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-2021119249-A1 | CYCLOPHILIN D INHIBITORS AND USES THEREOF | THE BROAD INSTITUTE, INC. (US) | 2021-06-17 | — | — | WO | disclosed |