Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 10/20 | 0.50 |
| ▸ | NPC1 | O15118 | 9/20 | 0.50 |
| ▸ | PKM | P14618 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18376957 | 0.81 | PARP1 (0.57) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL9979774 | 0.80 | L3MBTL1 (0.46) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL20860962 | 0.80 | GRIN2B (0.69) | RAB9AL3MBTL1TDP1 | |
| SCHEMBL23969506 | 0.79 | HPGD (0.47) | PARP1TDP1SMN1; SMN2HTTHPGD | |
| SCHEMBL26234540 | 0.79 | PARP1 (0.59) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL103985 | 0.79 | PARP1 (0.59) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL6841043 | 0.79 | PARP1 (0.59) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL103984 | 0.79 | PARP1 (0.59) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL29478724 | 0.79 | PARP1 (0.59) | PARP1RAB9ANPC1PKML3MBTL1 | |
| SCHEMBL6402429 | 0.78 | GRIN2B (0.61) | PARP1RAB9ANPC1PKML3MBTL1 |
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-RE43481-E1 | Diazepan derivatives or salts thereof | ASTELLAS PHARMA INC. (JP) | 2012-06-19 | — | — | US | disclosed |