Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL8486768 | 0.79 | CYP2A6 (0.59) | CYP2A6TAAR1SMN1; SMN2TP53RXFP1 | |
| SCHEMBL10950583 | 0.79 | CYP2A6 (0.54) | PKMCYP2A6TAAR1SMN1; SMN2TP53 | |
| SCHEMBL2534944 | 0.77 | CYP2A6 (0.53) | PKMCYP2A6TAAR1SMN1; SMN2TP53 | |
| SCHEMBL9265036 | 0.75 | TACR1 (0.55) | PKMCYP2A6TAAR1SMN1; SMN2TP53 | |
| SCHEMBL21274459 | 0.73 | SMN1; SMN2 (0.61) | CYP2A6TAAR1SMN1; SMN2TP53RXFP1 | |
| SCHEMBL4659729 | 0.73 | CYP2A6 (0.48) | PKMCYP2A6TAAR1SMN1; SMN2TP53 | |
| SCHEMBL28168069 | 0.73 | ALDH1A1 (0.67) | SMN1; SMN2MAPT | |
| SCHEMBL1686166 | 0.73 | ALDH1A1 (0.44) | MAPTMTNR1A | |
| Acetic Acid SCHEMBL7564503 | 0.72 | CYP2A6 (0.58) | PKMCYP2A6TAAR1SMN1; SMN2TP53 | |
| SCHEMBL760833 | 0.71 | MTNR1A (0.67) | PKMCYP2A6TAAR1SMN1; SMN2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0635508-B1 | TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS | ASAHI CHEMICAL IND (JP) | 1999-10-06 | — | — | EP | disclosed |
| US-5621103-A | 3-(SUBSTITUTED METHYLAMINOCARBONYL)-1,2,3,4-TETRAHYDRO-(1)BENZOTHIENO(2,3-C) PYRIDINES; ANXIOLYTIC AGENTS; LEARNING ENHANCEMENT | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1997-04-15 | — | — | US | disclosed |
| EP-0635508-A1 | TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1995-01-25 | — | — | EP | disclosed |
| EP-0386258-A1 | TETRAHYDROPYRIDINE DERIVATIVES | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1990-09-12 | — | — | EP | disclosed |