Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14703383 | 0.86 | MCHR1 (0.50) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL14703253 | 0.86 | TSHR (0.50) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL17777313 | 0.86 | MCHR1 (0.50) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL14703240 | 0.86 | MEN1 (0.46) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL14703148 | 0.86 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL14703378 | 0.86 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| Hydrochloric Acid SCHEMBL17668288 | 0.85 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| Hydrochloric Acid SCHEMBL17668293 | 0.85 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL16692416 | 0.85 | MCHR1 (0.48) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 | |
| SCHEMBL14703477 | 0.85 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2HTTALDH1A1 |
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-3222614-B1 | BIGUANIDE COMPOUND AND USE THEREOF | IMMUNOMET THERAPEUTICS INC (US) | 2020-07-29 | — | — | EP | disclosed |
| EP-3222614-A2 | BIGUANIDE COMPOUND AND USE THEREOF | Immunomet Therapeutics Inc. (US) | 2017-09-27 | — | — | EP | disclosed |