Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17644235 | 0.82 | ALDH1A1 (0.43) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL1465548 | 0.82 | ALDH1A1 (0.45) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL1465483 | 0.81 | LOXL2 (0.41) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL1465485 | 0.80 | MAPT (0.50) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL5718688 | 0.79 | ALDH1A1 (0.50) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL31735891 | 0.79 | TDP1 (0.50) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL15557574 | 0.79 | HSD17B10 (0.53) | TDP1ALDH1A1TSHRHTTGAA | |
| SCHEMBL28850334 | 0.78 | CYP3A4 (0.49) | TDP1ALDH1A1CYP3A4TSHRHTT | |
| SCHEMBL6776859 | 0.78 | ALDH1A1 (0.53) | TDP1ALDH1A1CYP3A4HTTALOX15 | |
| SCHEMBL28857833 | 0.77 | TDP1 (0.57) | TDP1ALDH1A1CYP3A4TSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1554271-A1 | SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS | Rigel Pharmaceuticals, Inc. (US) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004035571-A1 | SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS | RIGEL PHARMACEUTICALS, INC. (US) | 2004-04-29 | — | — | WO | disclosed |