Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA3 | P07451 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2185169 | 0.91 | RXRA (0.53) | ALDH1A1TP53TSHRKMT2APOLB | |
| SCHEMBL1604682 | 0.80 | ALDH1A1 (0.58) | ALDH1A1TP53TSHRKMT2APOLB | |
| SCHEMBL7519845 | 0.78 | ALDH1A1 (0.64) | ALDH1A1TP53TSHRKMT2APOLB | |
| SCHEMBL2989613 | 0.78 | ALDH1A1 (0.76) | ALDH1A1TP53TSHRKMT2ASRD5A2 | |
| SCHEMBL28457429 | 0.77 | LMNA (0.59) | ALDH1A1KMT2AL3MBTL1GAAMAPT | |
| SCHEMBL5197801 | 0.77 | MAPT (0.51) | ALDH1A1TP53TSHRKMT2APOLB | |
| SCHEMBL714706 | 0.77 | ALDH1A1 (0.54) | ALDH1A1TP53TSHRKMT2APOLB | |
| SCHEMBL5805280 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRKMT2APOLB | |
| Bicarbonate SCHEMBL9222817 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRKMT2APOLB | |
| SCHEMBL5576096 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRKMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5811422-A | USEFUL FOR TREATING VIRAL INFECTIONS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-09-22 | — | — | US | disclosed |
| US-5610294-A | VIRAL TREATMENT | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-03-11 | — | — | US | disclosed |