Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 3/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.55 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3242109 | 0.86 | KMT2A (0.58) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL28393239 | 0.85 | KMT2A (0.61) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL1107145 | 0.84 | MAPT (0.74) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL3236814 | 0.81 | KMT2A (0.65) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL7825018 | 0.81 | POLB (0.70) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL14578751 | 0.80 | POLB (0.85) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL23941256 | 0.80 | KMT2A (0.63) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL3240726 | 0.80 | MAPT (0.68) | NPC1TP53RAB9AKMT2APOLB | |
| SCHEMBL1064449 | 0.80 | HDAC1 (0.76) | KMT2APOLBGLAMAPTHDAC3 | |
| SCHEMBL25495658 | 0.80 | KMT2A (0.52) | NPC1TP53RAB9AKMT2APOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |
| WO-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |