Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TACR1 | P25103 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | DRD3 | P35462 | 3/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9387302 | 0.84 | SIGMAR1 (0.46) | KDM4ETACR1SIGMAR1MEN1KMT2A | |
| SCHEMBL8444407 | 0.82 | TACR1 (0.48) | KDM4ETACR1SIGMAR1MEN1KMT2A | |
| SCHEMBL28895871 | 0.82 | HDAC4 (0.54) | KDM4ESIGMAR1MEN1KMT2ADRD2 | |
| SCHEMBL5230745 | 0.81 | KDM4E (0.46) | KDM4ESIGMAR1MEN1KMT2ADRD2 | |
| SCHEMBL8901121 | 0.81 | DRD2 (0.35) | KDM4ESIGMAR1MEN1KMT2AATM | |
| SCHEMBL7948775 | 0.80 | SIGMAR1 (0.48) | KDM4ETACR1SIGMAR1MEN1KMT2A | |
| SCHEMBL10616944 | 0.78 | APOBEC3A (0.48) | KDM4ETACR1SIGMAR1MEN1KMT2A | |
| SCHEMBL12798134 | 0.76 | SIGMAR1 (0.55) | SIGMAR1DRD2HTTHTR1AHTR2A | |
| SCHEMBL14990696 | 0.73 | KDM4E (0.54) | KDM4ETACR1SIGMAR1MEN1KMT2A | |
| SCHEMBL28069755 | 0.73 | SIGMAR1 (0.55) | SIGMAR1DRD2HTTHTR1AHTR2A |
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-5994374-A | Substituted 1-indolylpropyl-4-benzyl-tetrahydropyridine derivatives | MERCK SHARP & DOHME LTD. (GB) | 1999-11-30 | — | — | US | disclosed |
| WO-1997017337-A1 | SUBSTITUTED 1-INDOLYLPROPYL-4-BENZYL-TETRAHYDROPYRIDINE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1997-05-15 | — | — | WO | disclosed |