Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 2/20 | 0.36 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9525431 | 0.86 | CYP2D6 (0.44) | CYP2D6CYP1A2MAPK1ALDH1A1RAB9A | |
| SCHEMBL9365826 | 0.84 | MAPK1 (0.39) | CYP2D6CYP1A2MAPK1ALDH1A1MAPT | |
| Dimethylamine SCHEMBL9526570 | 0.78 | CHRM4 (0.44) | ALDH1A1MAPTSMN1; SMN2NPC1PKM | |
| Diethylamine SCHEMBL9525434 | 0.77 | CHRM4 (0.41) | ALDH1A1MAPTSMN1; SMN2NPC1PKM | |
| SCHEMBL11800614 | 0.74 | RAD52 (0.45) | CYP2D6MAPK1ALDH1A1MAPTHTT | |
| Bromomethane SCHEMBL11880761 | 0.71 | ICAM1 (0.51) | CYP2D6MAPK1ALDH1A1MAPTHTT | |
| SCHEMBL11803145 | 0.71 | CYP2D6 (0.45) | CYP2D6MAPK1ALDH1A1MAPTHTT | |
| SCHEMBL9366092 | 0.71 | MEN1 (0.41) | CYP2D6CYP1A2MAPK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL9368107 | 0.71 | ALDH1A1 (0.46) | MAPK1ALDH1A1MAPTSMN1; SMN2RAB9A | |
| Hydrochloric Acid SCHEMBL11803670 | 0.71 | ALDH1A1 (0.46) | CYP2D6MAPK1ALDH1A1MAPTHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0297697-B1 | Thiophene-2-carboxamide derivatives and their pharmaceutical use | LILLY SA (ES) | 1993-12-29 | — | — | EP | disclosed |
| US-4904686-A | 3-ALKOXYTHIOPHENE-2-CARBOXAMIDES; CENTRAL NERVOUS SYSTEM DISORDERS | LILLY INDUSTRIES LIMITED (GB) | 1990-02-27 | — | — | US | disclosed |
| EP-0297697-A1 | Thiophene-2-carboxamide derivatives and their pharmaceutical use | LILLY S.A. (ES) | 1989-01-04 | — | — | EP | disclosed |