Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HPGDS | O60760 | 1/20 | 0.30 |
| ▸ | ALKBH2 | Q6NS38 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4296452 | 0.83 | HPGD (0.44) | SMN1; SMN2NPC1TP53RAB9ATSHR | |
| SCHEMBL5367157 | 0.75 | ALDH1A1 (0.34) | SMN1; SMN2TSHRKDM4EALDH1A1POLB | |
| SCHEMBL27815920 | 0.68 | ALDH1A1 (0.34) | SMN1; SMN2TSHRGAAPKMCYP2C19 | |
| SCHEMBL12042936 | 0.66 | CYP11B1 (0.32) | — | |
| SCHEMBL285565 | 0.66 | KDM4E (0.42) | SMN1; SMN2NPC1TP53RAB9ATSHR | |
| SCHEMBL27815929 | 0.65 | GRN (0.37) | SMN1; SMN2LMNAGAAKDM4EALDH1A1 | |
| SCHEMBL5361990 | 0.65 | CYP11B1 (0.37) | SMN1; SMN2TP53RAB9ATSHRLMNA | |
| SCHEMBL7540410 | 0.62 | ATM (0.36) | SMN1; SMN2NPC1TP53RAB9ACYP2C19 | |
| SCHEMBL8387760 | 0.62 | CYP11B1 (0.36) | TSHRKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL27761434 | 0.62 | KDM4E (0.33) | SMN1; SMN2TSHRKDM4EALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009119880-A1 | SUBSTITUTED PYRAZOLE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-10-01 | — | — | WO | disclosed |