Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | PKM | P14618 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4873486 | 0.92 | SMN1; SMN2 (0.47) | THRBTGFBR1MAPK14SMN1; SMN2KDM4E | |
| SCHEMBL5235795 | 0.90 | KDR (0.45) | TGFBR1ALDH1A1CYP1A2NPC1RAB9A | |
| SCHEMBL5231287 | 0.85 | NPC1 (0.49) | SMN1; SMN2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL4490632 | 0.83 | P2RX7 (0.39) | SMN1; SMN2KDM4EALDH1A1CYP1A2TSHR | |
| SCHEMBL6671176 | 0.83 | NPC1 (0.40) | SMN1; SMN2ALDH1A1NPC1RAB9ATP53 | |
| SCHEMBL5231489 | 0.83 | PRNP (0.45) | THRBTGFBR1MAPK14SMN1; SMN2KDM4E | |
| SCHEMBL23851296 | 0.82 | MTNR1A (0.52) | TGFBR1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31461239 | 0.82 | MTNR1A (0.52) | TGFBR1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5231308 | 0.81 | SRC (0.42) | TGFBR1AURKAMETKDRTEK | |
| SCHEMBL29959459 | 0.81 | CYP1A2 (0.49) | TGFBR1MAPK14SMN1; SMN2ALDH1A1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1543001-B1 | PYRAZOLOPYRIDINE DERIVATIVES AS TGF BETA SIGNAL TRANSDUCTION INHIBITORS FOR THE TREATMENT OF CANCER | LILLY CO ELI (US) | 2007-08-15 | — | — | EP | disclosed |
| EP-1397364-B1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | LILLY CO ELI (US) | 2007-07-25 | — | — | EP | disclosed |
| WO-2004026302-A1 | METHODS OF INHIBITING TGF BETA WITH SUBSTITUTED PYRAZOLES | ELI LILLY AND COMPANY (US) | 2004-04-01 | — | — | WO | disclosed |