Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 18/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HK1 | P19367 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | GALK1 | P51570 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30804579 | 0.78 | TRPA1 (0.59) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL1119424 | 0.78 | TRPA1 (0.59) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8588830 | 0.77 | TRPA1 (0.57) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8588251 | 0.77 | TRPA1 (0.57) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL30804590 | 0.77 | TRPA1 (0.57) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| SCHEMBL28794968 | 0.74 | TRPA1 (0.59) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| Morphanthridine SCHEMBL1150250 | 0.74 | TRPA1 (1.00) | TRPA1 | |
| SCHEMBL26661475 | 0.74 | TRPA1 (0.59) | TRPA1NPC1RAB9AHPGDSMN1; SMN2 | |
| Morphanthridine SCHEMBL1509656 | 0.72 | TRPA1 (0.96) | TRPA1 | |
| Formic Acid SCHEMBL28613405 | 0.71 | TRPA1 (0.50) | TRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6399629-B1 | PYRROLIDINES AND PIPERIDINES FOR TREATING MICROBIAL INFECTIONS BY REDUCING EXPORT OF COADMINISTERED ANTIMICROBIAL AGENT OR COMPOUND SYNTHESIZED BY MICROBES FOR THEIR GROWTH; REDUCING IN VIVO AVAILABILITY | MICROCIDE PHARMACEUTICALS, INC. | 2002-06-04 | — | — | US | disclosed |
| WO-2000001714-A1 | EFFLUX PUMP INHIBITORS | MICROCIDE PHARMACEUTICALS, INC. (US) | 2000-01-13 | — | — | WO | disclosed |