Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 4/20 | 0.57 |
| ▸ | IDO1 | P14902 | 1/20 | 0.55 |
| ▸ | NAMPT | P43490 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA7 | P43166 | 1/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL572740 | 0.94 | IDO1 (0.60) | CTSKIDO1NAMPTNPC1RAB9A | |
| SCHEMBL25048413 | 0.86 | CA1 (0.60) | CTSKIDO1NAMPTNPC1RAB9A | |
| SCHEMBL18800977 | 0.85 | NAMPT (0.58) | CTSKIDO1NAMPTNPC1RAB9A | |
| SCHEMBL8399561 | 0.85 | IDO1 (0.55) | CTSKIDO1NAMPTNPC1RAB9A | |
| SCHEMBL4583683 | 0.85 | POLB (0.65) | CTSKIDO1NPC1RAB9ASIGMAR1 | |
| Propionic Acid SCHEMBL8139542 | 0.85 | CA12 (0.61) | CTSKIDO1NAMPTRAB9ACA1 | |
| SCHEMBL8171226 | 0.85 | RAB9A (0.68) | NAMPTNPC1RAB9AMAPTTAAR1 | |
| SCHEMBL8573380 | 0.84 | SIGMAR1 (0.54) | CTSKIDO1NAMPTNPC1RAB9A | |
| SCHEMBL8785537 | 0.84 | CA2 (0.54) | CTSKIDO1NAMPTNPC1RAB9A | |
| SCHEMBL25054511 | 0.84 | NPC1 (0.55) | CTSKNPC1RAB9AMAPTTAAR1 |
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-0885186-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997019911-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1997-06-05 | — | — | WO | disclosed |