Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | ALPL | P05186 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | F2 | P00734 | 2/20 | 0.51 |
| ▸ | F12 | P00748 | 2/20 | 0.51 |
| ▸ | PLAU | P00749 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KRAS | P01116 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17323238 | 0.87 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL5035408 | 0.82 | F2 (0.59) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL17321504 | 0.80 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL2800393 | 0.77 | F2 (0.58) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL30030958 | 0.72 | NPC1 (0.66) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL2003184 | 0.72 | NPC1 (0.66) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL21777016 | 0.72 | SMN1; SMN2 (0.66) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| Dipyridyl SCHEMBL4954412 | 0.71 | KDM4E (0.56) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL8311588 | 0.70 | SMN1; SMN2 (1.00) | NPC1RAB9ASMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL27589462 | 0.69 | KAT6A (0.48) | KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3252049-A1 | PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-12-06 | — | — | EP | disclosed |
| EP-3252050-A1 | PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-12-06 | — | — | EP | disclosed |