Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.58 |
| ▸ | CTSL | P07711 | 4/20 | 0.58 |
| ▸ | CTSS | P25774 | 1/20 | 0.58 |
| ▸ | CTSK | P43235 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | ACE | P12821 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | APAF1 | O14727 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL25453628 | 0.86 | TACR1 (0.58) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL6430686 | 0.84 | TACR1 (0.56) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL16463539 | 0.82 | TACR1 (0.60) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL16463542 | 0.82 | TACR1 (0.60) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL6288440 | 0.82 | MAPT (0.56) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL7433228 | 0.81 | PKM (0.56) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL7433229 | 0.81 | PKM (0.56) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL6428086 | 0.81 | TACR1 (0.70) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL30406730 | 0.81 | TACR1 (0.66) | TACR1CTSLCTSSCTSKMAPT | |
| SCHEMBL7775097 | 0.81 | MAPT (0.65) | TACR1CTSLCTSSCTSKMAPT |
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-2021202600-A1 | SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-10-07 | — | — | WO | disclosed |