Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.53 |
| ▸ | PADI2 | Q9Y2J8 | 1/20 | 0.53 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.48 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | SPHK2 | Q9NRA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL7354961 | 1.00 | ALDH1A1 (0.54) | ALDH1A1PADI4PADI2SMYD3DAGLA | |
| SCHEMBL7347042 | 0.91 | ALDH1A1 (0.56) | ALDH1A1PADI4PADI2SMYD3DAGLA | |
| SCHEMBL7347037 | 0.91 | ALDH1A1 (0.56) | ALDH1A1PADI4PADI2SMYD3DAGLA | |
| SCHEMBL24450061 | 0.83 | SMYD3 (0.50) | PADI4PADI2SMYD3HDAC3HDAC1 | |
| SCHEMBL9516878 | 0.83 | PADI4 (0.51) | ALDH1A1PADI4PADI2SMYD3DAGLA | |
| Carbamic Acid SCHEMBL11235370 | 0.77 | HDAC3 (0.55) | ALDH1A1PADI4PADI2SMYD3DAGLA | |
| SCHEMBL25789987 | 0.76 | HTT (0.66) | ALDH1A1SMYD3RAB9ASMN1; SMN2HDAC3 | |
| SCHEMBL8594130 | 0.76 | HDAC3 (0.60) | ALDH1A1SMYD3DAGLARAB9ASMN1; SMN2 | |
| SCHEMBL24019954 | 0.76 | SMYD3 (0.56) | ALDH1A1SMYD3RAB9ANPC1HDAC3 | |
| SCHEMBL17137470 | 0.75 | PIN1 (0.52) | PADI4PADI2SMYD3DAGLARAB9A |
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-1992022313-A1 | RENIN INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 1992-12-23 | — | — | WO | disclosed |