Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 3/20 | 0.72 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MDM4 | O15151 | 1/20 | 0.54 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.54 |
| ▸ | CTSS | P25774 | 2/20 | 0.54 |
| ▸ | CTSK | P43235 | 2/20 | 0.54 |
| ▸ | CTSL | P07711 | 1/20 | 0.54 |
| ▸ | CTSB | P07858 | 1/20 | 0.54 |
| ▸ | ACE | P12821 | 1/20 | 0.53 |
| ▸ | PAM | P19021 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | TYR | P14679 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8710942 | 1.00 | TACR1 (0.72) | TACR1POLBTSHRMDM4MDM2 | |
| SCHEMBL30621980 | 0.94 | TACR1 (0.80) | TACR1POLBCTSSCTSKCTSL | |
| SCHEMBL5887474 | 0.89 | TACR1 (0.69) | TACR1POLBCTSSCTSKACE | |
| SCHEMBL5887859 | 0.89 | TACR1 (0.69) | TACR1POLBCTSSCTSKACE | |
| SCHEMBL2853641 | 0.89 | TACR1 (0.69) | TACR1POLBCTSSCTSKACE | |
| SCHEMBL2853645 | 0.89 | TACR1 (0.69) | TACR1POLBCTSSCTSKACE | |
| SCHEMBL5887863 | 0.89 | TACR1 (0.69) | TACR1POLBCTSSCTSKACE | |
| SCHEMBL5887473 | 0.89 | TACR1 (0.69) | TACR1POLBCTSSCTSKACE | |
| SCHEMBL8765789 | 0.88 | CTSL (0.58) | TACR1POLBTSHRMDM4MDM2 | |
| SCHEMBL3065366 | 0.87 | CTSL (0.64) | TACR1CTSSCTSKCTSLCTSB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116947858-A | Compounds selectively inhibiting four amino acid modifications of ADP, preparation and application thereof | 首都医科大学 | 2023-10-27 | — | — | CN | claimed |
| CN-116947858-A | Compounds selectively inhibiting four amino acid modifications of ADP, preparation and application thereof | 首都医科大学 | 2023-10-27 | — | — | CN | disclosed |
| US-5776902-A | Boronophenyl analogs of phospholyrosines | TRUSTEES OF TUFTS UNIVERSITY (US) | 1998-07-07 | — | — | US | disclosed |
| WO-1995025118-A2 | INHIBITORS OF SH2 DOMAIN INTERACTIONS | TRUSTEES OF TUFTS UNIVERSITY (US) | 1995-09-21 | — | — | WO | disclosed |