Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | TDP2 | O95551 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | GALK1 | P51570 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7221018 | 0.84 | KDM4E (0.38) | HPGDPOLBKDM4ECYP1A2 | |
| SCHEMBL7216087 | 0.84 | ALDH1A1 (0.40) | KMT2AALDH1A1GAAHPGDTSHR | |
| SCHEMBL7220910 | 0.78 | KDM4E (0.50) | KMT2AALDH1A1GAAHPGDTSHR | |
| SCHEMBL7445721 | 0.74 | TSHR (0.40) | KMT2AALDH1A1HPGDTSHRLMNA | |
| SCHEMBL7445727 | 0.73 | KDM4E (0.42) | KMT2AALDH1A1GAAHPGDTSHR | |
| SCHEMBL7220252 | 0.71 | RAB9A (0.46) | KMT2AALDH1A1HPGDTSHRMAPT | |
| SCHEMBL7214008 | 0.71 | BCL2 (0.39) | GAAHPGDTSHRLMNAHTT | |
| SCHEMBL28008252 | 0.70 | NLRP3 (0.50) | KMT2AALDH1A1GAAHPGDTSHR | |
| SCHEMBL7214201 | 0.69 | ALDH1A1 (0.34) | KMT2AALDH1A1GAAHPGDTSHR | |
| SCHEMBL1464939 | 0.67 | HPGD (0.53) | KMT2AALDH1A1GAAHPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6610692-B1 | Anticoagulants | MERCK & CO., INC. | 2003-08-26 | — | — | US | disclosed |