Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7803041 | 0.82 | ITGB1 (0.41) | ALDH1A1GAATSHRLMNAPOLB | |
| Citric Acid SCHEMBL7806947 | 0.82 | ALDH1A1 (0.33) | ALDH1A1GAATSHRLMNAPOLB | |
| SCHEMBL7803501 | 0.80 | ALDH1A1 (0.40) | ALDH1A1GAATSHRLMNAPOLB | |
| SCHEMBL7796811 | 0.80 | ALDH1A1 (0.46) | ALDH1A1GAATSHRLMNAPOLB | |
| Hydrochloric Acid SCHEMBL7803042 | 0.77 | MAOB (0.35) | ALDH1A1GAATSHRMAPTHSD17B10 | |
| SCHEMBL7804601 | 0.76 | GAA (0.48) | ALDH1A1GAATSHRLMNAPOLB | |
| SCHEMBL7804597 | 0.74 | ALDH1A1 (0.42) | ALDH1A1GAATSHRLMNAPOLB | |
| SCHEMBL8532155 | 0.72 | ALDH1A1 (0.44) | ALDH1A1GAATSHRLMNAPOLB | |
| SCHEMBL7703145 | 0.70 | ALDH1A1 (0.40) | ALDH1A1GAATSHRLMNAPOLB | |
| SCHEMBL7563154 | 0.68 | MAOB (0.46) | ALDH1A1GAATSHRMAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5981523-A | ADMINISTERING THIOMORPHOLINONE COMPOUND TO THE PATIENT SUFFERING FROM MULTIPLE SCLEROSIS | ELI LILLY AND COMPANY (US) | 1999-11-09 | — | — | US | disclosed |
| EP-0779282-A1 | Thiomorpholinone compounds for treating multiple sclerosis | ELI LILLY AND COMPANY (US) | 1997-06-18 | — | — | EP | disclosed |