Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.82 |
| ▸ | RAB9A | P51151 | 8/20 | 0.82 |
| ▸ | CASP3 | P42574 | 1/20 | 0.82 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.82 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.82 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.79 |
| ▸ | MEN1 | O00255 | 4/20 | 0.79 |
| ▸ | ATM | Q13315 | 1/20 | 0.79 |
| ▸ | MAOB | P27338 | 4/20 | 0.74 |
| ▸ | CA12 | O43570 | 1/20 | 0.72 |
| ▸ | CA1 | P00915 | 1/20 | 0.72 |
| ▸ | CA2 | P00918 | 1/20 | 0.72 |
| ▸ | CA9 | Q16790 | 1/20 | 0.72 |
| ▸ | GBA1 | P04062 | 1/20 | 0.67 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.62 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.61 |
| ▸ | MAOA | P21397 | 3/20 | 0.59 |
| ▸ | F12 | P00748 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL216822 | 0.90 | NPC1 (1.00) | NPC1RAB9ACASP3SENP7SENP6 | |
| SCHEMBL4972712 | 0.85 | MAOB (1.00) | MAOBCA12CA1CA2MAOA | |
| SCHEMBL11462954 | 0.79 | MAOB (0.91) | NPC1RAB9AMAOBCA12CA1 | |
| SCHEMBL15478030 | 0.75 | KMT2A (0.77) | NPC1RAB9ACASP3SENP7SENP6 | |
| SCHEMBL831792 | 0.74 | MAOB (1.00) | NPC1RAB9AMAOBMAOAF12 | |
| SCHEMBL8837333 | 0.73 | LCK (0.67) | NPC1RAB9ACASP3SENP7SENP6 | |
| SCHEMBL4412265 | 0.73 | NPC1 (0.61) | NPC1RAB9ACASP3SENP7SENP6 | |
| SCHEMBL6228344 | 0.73 | MAOB (1.00) | NPC1RAB9AKMT2AMEN1MAOB | |
| SCHEMBL4389144 | 0.72 | MAOA (1.00) | NPC1RAB9AMAOBCA12CA1 | |
| SCHEMBL4969156 | 0.72 | MAOB (0.76) | NPC1RAB9AMAOBCA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5648378-A | ANTICARCINOGENIC AGENTS FOR MAMMAL CELLS | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1997-07-15 | — | — | US | disclosed |
| WO-1996040670-A1 | 2-IMINOCHROMENE DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE KINASE | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1996-12-19 | — | — | WO | disclosed |