Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.39 |
| ▸ | CTSA | P10619 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.36 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL17039278 | 0.83 | FABP4 (0.41) | SMN1; SMN2LMNA | |
| SCHEMBL17039277 | 0.80 | NR1I2 (0.42) | SMN1; SMN2LMNAPDCD1CD274KDM4E | |
| SCHEMBL17029051 | 0.78 | NR1I2 (0.39) | SCN9A | |
| SCHEMBL17039256 | 0.75 | NR1I2 (0.41) | PDCD1CD274KDM4ERAB9ANPC1 | |
| SCHEMBL20344804 | 0.73 | ALDH1A3 (0.34) | SMN1; SMN2PDCD1CD274RAB9ANPC1 | |
| SCHEMBL20344807 | 0.73 | P2RX7 (0.33) | — | |
| SCHEMBL20344808 | 0.71 | GNRHR (0.35) | SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1 | |
| SCHEMBL3802345 | 0.64 | LMNA (0.48) | SMN1; SMN2LMNAKDM4ERAB9AALDH1A1 | |
| SCHEMBL9890675 | 0.62 | SMN1; SMN2 (0.49) | SMN1; SMN2LMNAKDM4E | |
| SCHEMBL12856837 | 0.61 | PTPRC (0.55) | SMN1; SMN2RAB9ANPC1ALDH1A1MAPT |
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-2015126765-A1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2015-08-27 | — | — | WO | disclosed |