Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 5/20 | 0.53 |
| ▸ | MMP2 | P08253 | 5/20 | 0.53 |
| ▸ | MMP9 | P14780 | 5/20 | 0.53 |
| ▸ | EGFR | P00533 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | NMT1 | P30419 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 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 | |
|---|---|---|---|---|
| SCHEMBL4418306 | 0.88 | MMP1 (0.53) | MMP1MMP2MMP9EGFRMAPT | |
| SCHEMBL4263459 | 0.87 | MMP1 (0.56) | MMP1MMP2MMP9EGFRMAPT | |
| SCHEMBL4268486 | 0.83 | MMP1 (0.53) | MMP1MMP2MMP9EGFRMAPT | |
| SCHEMBL4552432 | 0.81 | MAPT (0.43) | MMP1MMP2MMP9EGFRMAPT | |
| SCHEMBL4268646 | 0.78 | MMP1 (0.56) | MMP1MMP2MMP9EGFRMAPT | |
| SCHEMBL4551139 | 0.76 | ESR1 (0.50) | MAPTLMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL4264174 | 0.76 | ESR1 (0.50) | MAPTLMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL4267886 | 0.76 | ALDH1A1 (0.47) | MAPTSMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL4429251 | 0.75 | EGFR (0.49) | EGFRMAPTLMNAHTTHDAC1 | |
| Diphenylamine SCHEMBL4414722 | 0.75 | ESR1 (0.44) | MAPTLMNASMN1; SMN2NPC1RAB9A |
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-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | disclosed |