Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 2/20 | 0.40 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL16571417 | 0.86 | XDH (0.38) | ALOX15NPC1RAB9ARXFP1MEN1 | |
| SCHEMBL16571303 | 0.82 | GRM2 (0.42) | KDM4EALDH1A1HPGDIKBKBPDPK1 | |
| SCHEMBL24113538 | 0.80 | HRH4 (0.54) | ALOX15NPC1RAB9ARXFP1MEN1 | |
| SCHEMBL12581636 | 0.78 | PLA2G7 (0.50) | POLBLMNASYKPLA2G7 | |
| SCHEMBL16571653 | 0.78 | KMT2A (0.50) | ALOX15NPC1RAB9ARXFP1MEN1 | |
| SCHEMBL23165181 | 0.77 | ALOX15 (0.61) | ALOX15NPC1RAB9ARXFP1MEN1 | |
| SCHEMBL2760015 | 0.76 | KDM4E (0.66) | ALOX15NPC1RAB9ARXFP1MEN1 | |
| SCHEMBL19478398 | 0.74 | XDH (0.39) | ALOX15NPC1RAB9APTPN11SYK | |
| SCHEMBL16571121 | 0.74 | XDH (0.39) | ALOX15PTPN11NUDT1 | |
| SCHEMBL16570654 | 0.73 | RIPK1 (0.41) | ALOX15NPC1RAB9ARXFP1MEN1 |
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-3044207-A1 | INDOL-CARBOXAMIDE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2016-07-20 | — | — | EP | disclosed |
| WO-2015036412-A1 | INDOL-CARBOXAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2015-03-19 | — | — | WO | disclosed |