Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 3/20 | 0.54 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.54 |
| ▸ | HTR2C known ✓ | P28335 | 1/20 | 0.54 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.54 |
| ▸ | PTPRA | P18433 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | BLM | P54132 | 2/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | MPO | P05164 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11602580 | 1.00 | PTPRA (0.58) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL11604913 | 1.00 | PTPRA (0.58) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL128685 | 0.93 | KMT2A (0.66) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL18029175 | 0.93 | KMT2A (0.66) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL29405769 | 0.93 | KMT2A (0.66) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL30381542 | 0.93 | KMT2A (0.66) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL456668 | 0.93 | KMT2A (0.66) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL623336 | 0.93 | KMT2A (0.66) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL11605236 | 0.89 | KMT2A (0.59) | PTPRAKMT2AKDM4ELMNAMAPT | |
| SCHEMBL11603756 | 0.89 | KMT2A (0.59) | PTPRAKMT2AKDM4ELMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4072691-A | Process for the resolution of DL-6-chlorotryptophan | TANABE SEIYAKU CO., LTD. (JA) | 1978-02-07 | — | — | US | claimed |
| US-4072691-A | Process for the resolution of DL-6-chlorotryptophan | TANABE SEIYAKU CO., LTD. (JA) | 1978-02-07 | — | — | US | disclosed |
| US-4072691-A | Process for the resolution of DL-6-chlorotryptophan | TANABE SEIYAKU CO., LTD. (JA) | 1978-02-07 | — | — | US | disclosed |