Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13458590 | 0.81 | KMT2A (0.67) | RAB9ASMN1; SMN2NPC1HTTHPGD | |
| SCHEMBL15333875 | 0.81 | RAB9A (0.64) | RAB9ASMN1; SMN2NPC1HPGDKDM4E | |
| SCHEMBL7996336 | 0.80 | LMNA (0.63) | HTTKDM4EALDH1A1KMT2ABCHE | |
| SCHEMBL9911815 | 0.80 | APP (0.51) | PRMT5HTTKDM4EALDH1A1MAPT | |
| SCHEMBL29955055 | 0.80 | LMNA (0.63) | HTTKDM4EALDH1A1KMT2ABCHE | |
| SCHEMBL14885455 | 0.79 | RAB9A (0.62) | RAB9ASMN1; SMN2NPC1HTTHPGD | |
| SCHEMBL8846641 | 0.79 | PRMT5 (0.46) | RAB9ASMN1; SMN2NPC1PRMT5HTT | |
| SCHEMBL1427808 | 0.79 | SMN1; SMN2 (0.58) | RAB9ASMN1; SMN2NPC1PRMT5HTT | |
| SCHEMBL1813963 | 0.79 | APP (0.50) | PRMT5HTTKDM4EALDH1A1MAPT | |
| SCHEMBL14390810 | 0.79 | HSD17B10 (0.69) | RAB9ASMN1; SMN2NPC1PRMT5HTT |
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-2009143058-A1 | BICYCLIC COMPOUNDS HAVING ACTIVITY AT THE CXCR4 RECEPTOR | ALLERGAN, INC. (US) | 2009-11-26 | — | — | WO | disclosed |