Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | BMP1 | P13497 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7710387 | 0.90 | PARP1 (0.44) | ALDH1A1SMN1; SMN2TSHRHSD17B10KDM4E | |
| SCHEMBL7704945 | 0.88 | HDAC3 (0.44) | ALDH1A1SMN1; SMN2HSD17B10NPSR1ALOX15 | |
| SCHEMBL7704907 | 0.88 | HSD17B10 (0.38) | SMN1; SMN2TSHRHSD17B10POLBALOX15 | |
| SCHEMBL7704932 | 0.87 | HDAC3 (0.35) | HSD17B10MAPTALOX15 | |
| SCHEMBL7708363 | 0.86 | TP53 (0.35) | HSD17B10MAPTALOX15GAAMEN1 | |
| SCHEMBL7711422 | 0.86 | HSD17B10 (0.36) | ALDH1A1TSHRHSD17B10KDM4EBMP1 | |
| SCHEMBL6309617 | 0.86 | HDAC1 (0.43) | ALDH1A1SMN1; SMN2HSD17B10NPSR1ALOX15 | |
| SCHEMBL7704942 | 0.85 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2HSD17B10NPSR1POLB | |
| SCHEMBL7711006 | 0.85 | PARP1 (0.36) | ALDH1A1SMN1; SMN2TSHRHSD17B10KDM4E | |
| SCHEMBL7704966 | 0.85 | TP53 (0.37) | ALDH1A1TSHRHSD17B10KDM4EPOLB |
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-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |