Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.75 |
| ▸ | POLB | P06746 | 1/20 | 0.75 |
| ▸ | TSHR | P16473 | 4/20 | 0.68 |
| ▸ | USP2 | O75604 | 3/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 5/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL6280699 | 0.90 | ALDH1A1 (0.81) | ALDH1A1SMN1; SMN2TSHRUSP2LMNA | |
| SCHEMBL6279510 | 0.87 | KMT2A (0.73) | ALDH1A1SMN1; SMN2POLBTSHRUSP2 | |
| SCHEMBL6279351 | 0.85 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2TSHRUSP2LMNA | |
| SCHEMBL6280222 | 0.83 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2TSHRUSP2LMNA | |
| SCHEMBL6280252 | 0.82 | MEN1 (0.67) | ALDH1A1SMN1; SMN2POLBTSHRUSP2 | |
| SCHEMBL6274723 | 0.82 | ALDH1A1 (0.86) | ALDH1A1SMN1; SMN2POLBTSHRUSP2 | |
| SCHEMBL6279393 | 0.80 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2POLBTSHRUSP2 | |
| SCHEMBL6273823 | 0.79 | KMT2A (1.00) | ALDH1A1SMN1; SMN2POLBTSHRUSP2 | |
| SCHEMBL6274351 | 0.78 | MEN1 (0.80) | ALDH1A1SMN1; SMN2TSHRUSP2LMNA | |
| SCHEMBL6273841 | 0.78 | KMT2A (0.69) | ALDH1A1SMN1; SMN2TSHRUSP2LMNA |
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-2005115147-A2 | HIV REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2005-12-08 | — | — | WO | disclosed |