Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.47 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.47 |
| ▸ | PPP5C | P53041 | 2/20 | 0.44 |
| ▸ | PPP2CA | P67775 | 1/20 | 0.44 |
| ▸ | TFPI2 | P48307 | 1/20 | 0.44 |
| ▸ | NPY4R | P50391 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8252217 | 1.00 | HTT (0.68) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL2688841 | 0.90 | ALDH1A1 (0.60) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL2075903 | 0.90 | HTT (0.81) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL16134884 | 0.89 | HTT (0.59) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL19651225 | 0.85 | HTT (0.53) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL8194135 | 0.84 | HTT (0.71) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL15199119 | 0.82 | HTT (0.70) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL14409695 | 0.82 | HTT (0.70) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL18390863 | 0.82 | HTT (0.70) | HTTLMNAALDH1A1TSHRHPGD | |
| SCHEMBL15075709 | 0.82 | HTT (0.55) | HTTLMNAALDH1A1TSHRHPGD |
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-3558979-B1 | NOVEL BENZYLAMINO SUBSTITUTED QUINAZOLINES AND DERIVATIVES AS SOS1 INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2021-02-17 | — | — | EP | disclosed |
| WO-2018115380-A1 | NOVEL BENZYLAMINO SUBSTITUTED QUINAZOLINES AND DERIVATIVES AS SOS1 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2018-06-28 | — | — | WO | disclosed |