Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ACR | P10323 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | RPA1 | P27694 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18558486 | 0.92 | NPC1 (0.40) | NPC1RAB9AACRCA12ALPL | |
| SCHEMBL18558653 | 0.90 | IDO1 (0.39) | NPC1RAB9AACRCA12ALPL | |
| SCHEMBL18558410 | 0.90 | CA12 (0.37) | NPC1RAB9AKMT2AALOX15MEN1 | |
| SCHEMBL18558676 | 0.89 | MAPT (0.40) | NPC1RAB9AKMT2AALOX15MEN1 | |
| SCHEMBL18558487 | 0.89 | ALPL (0.42) | SMN1; SMN2NPC1RAB9AACRCA12 | |
| SCHEMBL18558230 | 0.89 | ADCY8 (0.42) | KMT2AMEN1ACRCA12ALPL | |
| SCHEMBL18556491 | 0.88 | CA12 (0.35) | SMN1; SMN2NPC1RAB9AACRCA12 | |
| SCHEMBL18558665 | 0.88 | MAPT (0.48) | SMN1; SMN2NPC1RAB9AKMT2AALOX15 | |
| SCHEMBL18558256 | 0.87 | VNN1 (0.39) | ACRCA12ALPLRPA1CYP2C19 | |
| SCHEMBL18557570 | 0.87 | VNN1 (0.40) | SMN1; SMN2ACRCA12ALPLRPA1 |
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-9580388-B2 | Pyrazolyl guanidine F1F0-ATPase inhibitors and therapeutic uses thereof | LYCERA CORPORATION (US) | 2017-02-28 | — | — | US | disclosed |