Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.66 |
| ▸ | RAB9A | P51151 | 9/20 | 0.66 |
| ▸ | MEN1 | O00255 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.66 |
| ▸ | CASP3 | P42574 | 2/20 | 0.66 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.66 |
| ▸ | HPGD | P15428 | 3/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.66 |
| ▸ | MAPT | P10636 | 3/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.66 |
| ▸ | ESR1 | P03372 | 2/20 | 0.66 |
| ▸ | TP53 | P04637 | 2/20 | 0.66 |
| ▸ | POLB | P06746 | 2/20 | 0.66 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.66 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.66 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.66 |
| ▸ | FLT3 | P36888 | 7/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL3392428 | 0.81 | NPC1 (0.73) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL5453337 | 0.80 | RAB9A (1.00) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL3403591 | 0.79 | NPC1 (1.00) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL3128198 | 0.77 | FLT3 (1.00) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL24490620 | 0.77 | CFTR (0.95) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL24489118 | 0.77 | CFTR (0.71) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL3914843 | 0.77 | HPGD (0.98) | NPC1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL8289672 | 0.76 | FLT3 (0.97) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL8290832 | 0.76 | NPC1 (1.00) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL8289830 | 0.75 | FLT3 (0.95) | NPC1RAB9AMEN1KMT2ACASP3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005033102-A2 | THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | AMPHORA DISCOVERY CORPORATION (US) | 2005-04-14 | — | — | WO | disclosed |