Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | HTR1F | P30939 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7993333 | 0.80 | NR1H4 (0.45) | NR1H4KDM4EALDH1A1NPSR1POLB | |
| SCHEMBL7979061 | 0.76 | PDE4D (0.39) | KDM4EALDH1A1POLBRAB9ASMN1; SMN2 | |
| SCHEMBL7993247 | 0.76 | KDM4E (0.43) | KDM4EALDH1A1NPSR1TSHRHSD17B10 | |
| SCHEMBL8012751 | 0.75 | ADRA2A (0.46) | ALDH1A1POLBHPGDNPC1RAB9A | |
| SCHEMBL8025490 | 0.73 | DRD2 (0.51) | KDM4EALDH1A1TSHRHSD17B10HPGD | |
| SCHEMBL7991365 | 0.72 | BRPF1 (0.43) | KDM4EALDH1A1NPSR1POLBNPC1 | |
| SCHEMBL7993464 | 0.72 | KMT2A (0.42) | KDM4EALDH1A1NPSR1TSHRHSD17B10 | |
| SCHEMBL8025533 | 0.69 | DRD2 (0.43) | — | |
| SCHEMBL22863188 | 0.69 | DRD1 (0.41) | KMT2AMEN1 | |
| SCHEMBL24252069 | 0.69 | NR1H4 (0.59) | NR1H4KDM4EALDH1A1HSD17B10HPGD |
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-6277861-B1 | FOR TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISORDERS, PSYCHOLOGICAL DISORDERS, MUSCULAR DISORDERS, DRUG ADDICTION WITHDRAWAL, PAIN | SMITHKLINE BEECHAM, P.L.C. (GB) | 2001-08-21 | — | — | US | disclosed |